![C50H60N5O10P cýtídín, N-benzóýl-5 ′ -O- [bis (4-metoxýfenýl) fenýlmetýl] -2 ′ -O- (2-metoxýetýl)-5-metýl-, 3 ′-[2-cyanoethyl n, n-bis (1-metýletýl) fosphoramidite] (aci)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C50H60N5O10P cýtídín, N-bensóýl-5 ′ -O- [BIS (4-metoxýfenýl) fenýlmetýl] -2 ′ -O- (2-metoxýetýl)-5-metýl-, 3 ′-[2-cyanoethyl n, n-bis (1-metýl) fosphoramidite] (aci) sem fylgir mynd (1 metýletýl) fosphoramidite] (aci).](https://cdn.globalso.com/nvchem/C50H60N5O10P-Cytidine.png)
C50H60N5O10P cýtídín, N-benzóýl-5 ′ -O- [bis (4-metoxýfenýl) fenýlmetýl] -2 ′ -O- (2-metoxýetýl)-5-metýl-, 3 ′-[2-cyanoethyl n, n-bis (1-metýletýl) fosphoramidite] (aci)
CAS skrásetningarnúmer
163759-94-2
| Lykilatriði eðlisfræðilegra eiginleika | Gildi | Ástand |
| Mólmassa | 922.01 | - |
| PKA (spáð) | 8,59 ± 0,40 | Sýrtasta temp: 25 ° C |
Canonical bros
N#CCCOP (OC1C (OC (N2C = C (C (= NC2 = O) NC (= O) C = 3C = CC = CC3) C) C1OCCOC) COC (C = 4C = CC = CC4) (C5 = CC = C (OC) C = C5) C6 = CC = C (OC) C = C 6) N (C (C) C) C (C) C
Isomicer bros
C (OC [C @@ H] 1 [C @@ H] (OP (N (C (C) C) C (C) C) OCCC#N) [C @@ H] (OCCOC) [C @@ H] (O1) N2C (= O) N = C (NC (= O) C3 = CC = CC = C3) C (C) = C2) (C4 = CC = C (OC) C = C4) (C5 = CC = C (OC) C = C5) C6 = CC = CC = C6
Tommur
Inchi = 1s/C50H60N5O10P/C1-34 (2) 55 (35 (3) 4) 66 (63-29-15-28-51) 65-44-43 (33-62-50 (38-18-13-10-14-19-38,39-20-24-41 (59-7) 25-21-39 ) 40-22-26-42 (60-8) 27-23-40) 64-48 (45 (44) 61-31-30-58-6) 54-32-36 (5) 46 (53-49 (54) 57) 52-47 (56) 37-16-11-9-12-17-37/H97 35,43-45,48H, 15,29-31,33H2,1-8H3, (H, 52,53,56,57)/T43-, 44-, 45-, 48-, 66?/M1/S1
Inchi lykill
Fligvmliidvdsn-gicdfoiUSA-n
26 önnur nöfn fyrir þetta efni
Cytidine,N-benzoyl -5 ′ -O-[bis (4-metoxýfenýl) fenýlmetýl] -2 ′-O-(2-metoxýetýl)-5-metýl-, 3 ′-[2-cyanoethyl bis (1-metýl) fosfóramídít] (9ci); 12: PN: WO03084478 Bls: 57 krafist DNA; 14: PN: US20030170636 Page: 17 krafist DNA; 15: Pn: U.
S20030211606 Page: 19 krafist DNA; 15: PN: US20030212017 Page: 19 krafist DNA; 16: PN: US20040005569 Bls: 22 krafist DNA; 17: PN: US20040006030 Page: 23 krafist DNA; 17: PN: US20040014049 Bls: 20 krafist DNA; 18: PN: US20040014047 PAG E: 20 krafist DNA; 18: PN: US20040014048 Page: 20 krafist DNA; 18: PN: US20040014050 Page: 20 krafist DNA; 19: Pn: U.
S20030171313 Bls: 9 krafist DNA; 19: PN: US20030198965 Page: 20 krafist DNA; 19: PN: US20040005565 Page: 17-22 Kröfur DNA; 19: PN: US20040005570 Page: 20 krafist DNA; 19: PN: US20040014051 Page: 22 krafist DNA; 20: PN: US20040014699 PAG
E: 20 krafðist DNA; 21: PN: US20040006029 Bls: 23 krafist DNA; 21: PN: WO03106645 Bls: 72 krafist DNA; 61: PN: US20030
166592 Bls: 15 krafist DNA; 7: PN: WO2005006958 Page: 62 krafist DNA; 84: PN: US20040171566 Page: 18 krafist DNA; 92:
PN: US20040005707 Page: 20 krafist DNA; 9: PN: WO2005007825 Page: 62 krafist DNA;N4-benzoyl-2 ′-O-metoxýetýl-5-O-dimethoxytityyl-5-metýlsýtidín-3 ′-fosfóramídít;N4-benzoyl-2 ′-O-metoxýetýl -5 ′ -O-Dimethoxytrityyl-5-metýlsýtidín-3 ′-amidite
Litróf í boði
13 C nmr
Hetero nmr
Eignir í boði
Líffræðileg
Efni
Lipinski
Uppbygging tengd
| Eign | Gildi | Ástand | Uppspretta |
| Bioconcentration Factor | 171 | pH 1; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 1250 | pH 2; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 47600 | Ph 3; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 6,44 x 105 | pH 4; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 1,00 x 106 | pH 5; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 1,00 x 106 | pH 6; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 1,00 x 106 | pH 7; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 7,79 x 105 | pH 8; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 1,63 x 105 | pH 9; Temp: 25 ° C. | (1) ACD |
| Bioconcentration Factor | 30800 | pH 10; Temp: 25 ° C. | (1) ACD |
(1) Reiknuð með Advanced Chemistry Development (ACD/Labs) hugbúnaði V11.02 (© 1994-2023 ACD/Labs)
| Eign | Gildi | Ástand | Uppspretta |
| KOC | 106 | pH 1; Temp: 25 ° C. | (1) ACD |
| KOC | 773 | pH 2; Temp: 25 ° C. | (1) ACD |
| KOC | 29500 | Ph 3; Temp: 25 ° C. | (1) ACD |
| Eign | Gildi | Ástand | Uppspretta |
| KOC | 3,99 x 105 | pH 4; Temp: 25 ° C. | (1) ACD |
| KOC | 8.02 x 105 | pH 5; Temp: 25 ° C. | (1) ACD |
| KOC | 8,70 x 105 | pH 6; Temp: 25 ° C. | (1) ACD |
| KOC | 8.16 x 105 | pH 7; Temp: 25 ° C. | (1) ACD |
| KOC | 4,83 x 105 | pH 8; Temp: 25 ° C. | (1) ACD |
| KOC | 1,01 x 105 | pH 9; Temp: 25 ° C. | (1) ACD |
| KOC | 19100 | pH 10; Temp: 25 ° C. | (1) ACD |
| logd | 4.48 | pH 1; Temp: 25 ° C. | (1) ACD |
| logd | 5.34 | pH 2; Temp: 25 ° C. | (1) ACD |
| logd | 6.92 | Ph 3; Temp: 25 ° C. | (1) ACD |
| logd | 8.06 | pH 4; Temp: 25 ° C. | (1) ACD |
| logd | 8.36 | pH 5; Temp: 25 ° C. | (1) ACD |
| logd | 8.39 | pH 6; Temp: 25 ° C. | (1) ACD |
| logd | 8.37 | pH 7; Temp: 25 ° C. | (1) ACD |
| logd | 8.14 | pH 8; Temp: 25 ° C. | (1) ACD |
| logd | 7.46 | pH 9; Temp: 25 ° C. | (1) ACD |
| logd | 6,73 | pH 10; Temp: 25 ° C. | (1) ACD |
| logp | 8.401 ± 0,723 | Temp: 25 ° C. | (1) ACD |
| Massa eðlislægni | 1,4 x 10-4 g/l | Temp: 25 ° C. | (1) ACD |
| Massa leysni | 1,1 g/l | pH 1; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 0,16 g/l | pH 2; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 4,1 x 10-3 g/l | Ph 3; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 3,0 x 10-4 g/l | pH 4; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 1,5 x 10-4 g/l | pH 5; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 1,4 x 10-4 g/l | pH 6; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 1,5 x 10-4 g/l | pH 7; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 2,5 x 10-4 g/l | pH 8; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 1,2 x 10-3 g/l | pH 9; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 6,3 x 10-3 g/l | pH 10; Temp: 25 ° C. | (1) ACD |
| Massa leysni | 1,5 x 10-4 g/l | Óbifað vatn pH 6,97; Temp: 25 ° C. | (1) ACD |
| Molar innri leysni | 1,5 x 10-7 mól/l | Temp: 25 ° C. | (1) ACD |
| Molar leysni | 1,2 x 10-3 mól/l | pH 1; Temp: 25 ° C. | (1) ACD |
| Eign | Gildi | Ástand | Uppspretta |
| Molar leysni | 1,7 x 10-4 mól/l | pH 2; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 4,4 x 10-6 mól/l | Ph 3; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 3,2 x 10-7 mól/l | pH 4; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 1,6 x 10-7 mól/l | pH 5; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 1,5 x 10-7 mól/l | pH 6; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 1,6 x 10-7 mól/l | pH 7; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 2,7 x 10-7 mól/l | pH 8; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 1,3 x 10-6 mól/l | pH 9; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 6,8 x 10-6 mól/l | pH 10; Temp: 25 ° C. | (1) ACD |
| Molar leysni | 1,6 x 10-7 mól/l | Óbifað vatn pH 6,97; Temp: 25 ° C. | (1) ACD |
| Mólmassa | 922.01 | ||
| PKA | 8,59 ± 0,40 | Sýrtasta temp: 25 ° C | (1) ACD |
| PKA | 3,87 ± 0,20 | Grundvöllurinn: 25 ° C | (1) ACD |
(1) Reiknuð með Advanced Chemistry Development (ACD/Labs) hugbúnaði V11.02 (© 1994-2023 ACD/Labs)
| Eign | Gildi | Ástand | Uppspretta |
| Frjálslega snúningsbönd | 22 | (1) ACD | |
| H samþykki | 15 | (1) ACD | |
| H styrktaraðilar | 1 | (1) ACD | |
| H gjafa/samþykki fjárhæð | 16 | (1) ACD | |
| logp | 8.401 ± 0,723 | Temp: 25 ° C. | (1) ACD |
| Mólmassa | 922.01 |
(1) Reiknuð með Advanced Chemistry Development (ACD/Labs) hugbúnaði V11.02 (© 1994-2023 ACD/Labs)
| Eign | Gildi | SKILYRÐI |
| Polar yfirborð | 176 A2 | (1) ACD |
(1) Reiknuð með Advanced Chemistry Development (ACD/Labs) hugbúnaði V11.02 (© 1994-2023 ACD/Labs)
Litróf í boði
1 klst. NMR
13 C nmr
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