![C41H49FN5O8P Cytidine, N-acetyl-5'-O- [bis(4-methoxyphenyl) phenylmethyl]-2'-deoxy-2'-fluoro-, 3'- [2-cyanoethyl N, N-bis(1-methylethyl) fosfoor amiite] (ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C41H49FN5O8P Cytidine, N-acetyl-5'-O- [bis(4-methoxyphenyl) phenylmethyl]-2'-deoxy-2'-fluoro-, 3'- [2-cyanoethyl N, N-bis(1-methylethyl) phosphor amidite] (ACI) Sawirka sifaysan](https://cdn.globalso.com/nvchem/C41H49FN5O8P-Cytidine.png)
C41H49FN5O8P Cytidine, N-acetyl-5'-O- [bis(4-methoxyphenyl) phenylmethyl]-2'-deoxy-2'-fluoro-, 3'- [2-cyanoethyl N, N-bis(1-methylethyl) fosfoor amiite] (ACI)
Lambarka Diiwaanka CAS
159414-99-0
| Qalabka Jidhka ee Furaha ah | Qiimaha | Xaalad |
| Miisaanka Molecular | 789.83 | - |
| pKa (La saadaaliyay) | 10.11 ± 0.20 | Heerkulka ugu acidic badan: 25 °C |
Dhoola-cadaynta Canonical
N#CCCOP(OC1C(F)C(OC1COC(C=2C=CC=CC2)(C3=CC=C(OC)C=C3)C4=CC=C(OC)C=C4)N5C=CC(= NC5=O)NC(=O)C)N(C(C)C)C(C)C
Dhoola-caddeyn
C (OC[C@@H]1[C@@H] (OP(N(C(C)C)C(C)C)OCCC#N)[C@@H](F)[C@@ H](O1)N2C(=O)N=C(NC(C)=O)C=C2)(C3=CC=C(OC)C=C3)(C4=CC=C) (OC)C=C4)C5=CC=CC=C5
InChi
InChi= 1S/C41H49FN5O8P/c1-27(2)47(28(3)4)56(53-25-11-23-43)55-38-35(54-39(37(38)42)46-24- 22-36 (44-29 (5)48)45-40 (46)49)26-52- 41 (30-12-9-8-10-13-30,31-14-18-33(50-6)19-15-31)32-16-20-34(51) -7)21-17-32/h8-10,12-22,24,27-28,35,37-39H,11,25-26H2,1-7H3,(H, 44,45,48,49)/t35-,37-,38-,39-,56?/m1/s1
Furaha InChi
CNFKJHKDSRXNFL-UTXREMQHSA-N
1 Magaca kale ee walaxdan
Cytidine,N-acetyl-5′-O- [bis (4-methoxyphenyl) phenylmethyl] -2'-deoxy-2'-fluoro-, 3'- [2-cyanoethyl bis (1-methylethyl) fosfoor amidite] (9CI)
Spectra waa la heli karaa
Mass
Guryaha la heli karo
Nafley
Kiimiko
Lipinski
Qaab-dhismeedka La Xiriira
| Hanti | Qiimaha | Xaalad | Xigasho |
| Qodobka bioconcentration | 8.60 | pH 1; Heerkulka: 25 °C | (1) ACD |
| Qodobka bioconcentration | 90.3 | pH 2; Heerkulka: 25 °C | (1) ACD |
| Qodobka bioconcentration | 3940 | pH 3; Heerkulka: 25 °C | (1) ACD |
| Qodobka bioconcentration | 39100 | pH 4; Heerkulka: 25 °C | (1) ACD |
| Qodobka bioconcentration | 64300 | pH 5; Heerkulka: 25 °C | (1) ACD |
| Qodobka bioconcentration | 68100 | pH 6; Heerkulka: 25 °C | (1) ACD |
| Qodobka bioconcentration | 68300 | pH 7; Heerkulka: 25 °C | (1) ACD |
| Qodobka bioconcentration | 66800 | pH 8; Heerkulka: 25 °C | (1) ACD |
| Qodobka bioconcentration | 54300 | pH 9; Heerkulka: 25 °C | (1) ACD |
| Qodobka bioconcentration | 19200kii | pH 10; Heerkulka: 25 °C | (1) ACD |
(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Hanti | Qiimaha | Xaalad | Xigasho |
| Koc | 12.6 | pH 1; Heerkulka: 25 °C | (1) ACD |
| Koc | 133 | pH 2; Heerkulka: 25 °C | (1) ACD |
| Koc | 5790 | pH 3; Heerkulka: 25 °C | (1) ACD |
| Koc | 57400 | pH 4; Heerkulka: 25 °C | (1) ACD |
| Koc | 94500 | pH 5; Heerkulka: 25 °C | (1) ACD |
| Koc | 1.00 x 105 | pH 6; Heerkulka: 25 °C | (1) ACD |
| Koc | 1.00 x 105 | pH 7; Heerkulka: 25 °C | (1) ACD |
| Koc | 98200 | pH 8; Heerkulka: 25 °C | (1) ACD |
| Koc | 79700 | pH 9; Heerkulka: 25 °C | (1) ACD |
| Koc | 28200 | pH 10; Heerkulka: 25 °C | (1) ACD |
| Hanti | Qiimaha | Xaalad | Xigasho |
| logD | 2.76 | pH 1; Heerkulka: 25 °C | (1) ACD |
| logD | 3.79 | pH 2; Heerkulka: 25 °C | (1) ACD |
| logD | 5.43 | pH 3; Heerkulka: 25 °C | (1) ACD |
| logD | 6.42 | pH 4; Heerkulka: 25 °C | (1) ACD |
| logD | 6.64 | pH 5; Heerkulka: 25 °C | (1) ACD |
| logD | 6.66 | pH 6; Heerkulka: 25 °C | (1) ACD |
| logD | 6.66 | pH 7; Heerkulka: 25 °C | (1) ACD |
| logD | 6.65 | pH 8; Heerkulka: 25 °C | (1) ACD |
| logD | 6.56 | pH 9; Heerkulka: 25 °C | (1) ACD |
| logD | 6.11 | pH 10; Heerkulka: 25 °C | (1) ACD |
| logP | 6.666± 0.764 | Heerkulka: 25 °C | (1) ACD |
| Solubility Mass Intrinsic | 4.5 x 10-5 g/L | Heerkulka: 25 °C | (1) ACD |
| Xalka tirada badan | 0.36 g/L | pH 1; Heerkulka: 25 °C | (1) ACD |
| Xalka tirada badan | 0.035 g/L | pH 2; Heerkulka: 25 °C | (1) ACD |
| Xalka tirada badan | 7.90 x 10-4 g/L | pH 3; Heerkulka: 25 °C | (1) ACD |
| Xalka tirada badan | 7.9 x 10-5 g/L | pH 4; Heerkulka: 25 °C | (1) ACD |
| Xalka tirada badan | 4.8 x 10-5 g/L | pH 5; Heerkulka: 25 °C | (1) ACD |
| Xalka tirada badan | 4.6 x 10-5 g/L | pH 6; Heerkulka: 25 °C | (1) ACD |
| Xalka tirada badan | 4.6 x 10-5 g/L | pH 7; Heerkulka: 25 °C | (1) ACD |
| Xalka tirada badan | 4.7 x 10-5 g/L | pH 8; Heerkulka: 25 °C | (1) ACD |
| Xalka tirada badan | 5.7 x 10-5 g/L | pH 9; Heerkulka: 25 °C | (1) ACD |
| Xalka tirada badan | 1.6 x 10-4 g/L | pH 10; Heerkulka: 25 °C | (1) ACD |
| Xalka tirada badan | 4.6 x 10-5 g/L | Biyaha aan la daboolin pH 7.00; Heerkulka: 25 °C | (1) ACD |
| Solubility Intrinsic Molar | 5.7 x 10-8 mol/L | Heerkulka: 25 °C | (1) ACD |
| Solubility Molar | 4.6 x 10-4 mol/L | pH 1; Heerkulka: 25 °C | (1) ACD |
| Solubility Molar | 4.4 x 10-5 mol/L | pH 2; Heerkulka: 25 °C | (1) ACD |
| Solubility Molar | 1.00 x 10-6 mol/L | pH 3; Heerkulka: 25 °C | (1) ACD |
| Solubility Molar | 1.0 x 10-7 mol/L | pH 4; Heerkulka: 25 °C | (1) ACD |
| Solubility Molar | 6.1 x 10-8 mol/L | pH 5; Heerkulka: 25 °C | (1) ACD |
| Solubility Molar | 5.8 x 10-8 mol/L | pH 6; Heerkulka: 25 °C | (1) ACD |
| Solubility Molar | 5.8 x 10-8 mol/L | pH 7; Heerkulka: 25 °C | (1) ACD |
| Solubility Molar | 5.9 x 10-8 mol/L | pH 8; Heerkulka: 25 °C | (1) ACD |
| Hanti | Qiimaha | Xaalad | Xigasho |
| Solubility Molar | 7.2 x 10-8 mol/L | pH 9; Heerkulka: 25 °C | (1) ACD |
| Solubility Molar | 2.0 x 10-7 mol/L | pH 10; Heerkulka: 25 °C | (1) ACD |
| Solubility Molar | 5.8 x 10-8 mol/L | Biyaha aan la daboolin pH 7.00; Heerkulka: 25 °C | (1) ACD |
| Miisaanka Molecular | 789.83 | ||
| pKa | 10.11 ± 0.20 | Heerkulka ugu acidic badan: 25 °C | (1) ACD |
| pKa | 3.57±0.20 | Heerkulka ugu badan ee aasaasiga ah: 25 °C | (1) ACD |
(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Hanti | Qiimaha | Isha Xaaladda |
| Aagga dusha sare ee Polar | 158 A2 | (1) ACD |
(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
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