![C47H51FN7O7P Adenosine, N-benzoyl-5 ′ -O- fosifore amidite] (ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C47H51FN7O7P Adenosine, N-benzoyl-5 ′ -O- fosifori amidite] (ACI) Ishusho Yerekanwe](https://cdn.globalso.com/nvchem/C47H51FN7O7P-Adenosine.png)
C47H51FN7O7P Adenosine, N-benzoyl-5 ′ -O- fosifore amidite] (ACI)
Numero ya CAS
136834-22-5
| Ibyingenzi Byumubiri | Agaciro | Imiterere |
| Uburemere bwa molekile | 875.92 | - |
| pKa (Byahanuwe) | 7.87 ± 0.43 | Ubushyuhe bwinshi bwa Acide: 25 ° C. |
Urwenya rwa Canonical
N # CCCOP (OC1C (F) C (OC1COC (C = 2C = CC = CC2) (C3 = CC = C (OC) C = C3) C4 = CC = C (OC) C = C4) N5C = NC = 6C (= NC = NC65) NC (= O) C = 7C = CC = CC7) N (C (C) C) C (C) C
Isomeric SMILES
C (OC [C @@ H] 1 [C @@ H] (OP (N (C (C) C) C (C) C) OCCC # N) [C @@ H] (F) [C @@ H] (O1) N2C = 3C (N = C2) = C (NC (= O) C4 = CC = CC = C4) N = CN3) (C5 = CC = C (OC) C = C5) (C6 = CC = C (OC) C = C6) C7 = CC = CC = C7
InChI
InChI = 1S / C47H51FN7O7P / c1-31 (2) 55 (32 (3) 4) 63 (60-27-13-26-49) 62-42-39 (61-46 (40 (42) 48) 54- 30-52-41-43 (50-29-51-44 (41) 54) 53-45 (56) 33-14-9-7-10-15-33) 28-59-47 (34-16- 11-8-12-17-34,35-18-22-37 (57-5) 23-19-35) 36-20-24-38 (58-6) 25-21-36 / h7-12, 14-25,29-32,39-40,4 2,46H, 13,27-28H2,1-6H3, (H, 50,51,53,56) / t39-, 40-, 42-, 46- , 63? / M1 / s1
InChI Urufunguzo
VCCMVPDSLHFCBB-MSIRFHFKSA-N
1 Irindi zina kuriyi ngingo
Adenosine,N-benzoyl-5 ′ -O- [bis.
Ibyiza birahari
Ibinyabuzima
Imiti
Lipinski
Imiterere ijyanye
| Umutungo | Agaciro | Imiterere | Inkomoko |
| Ikintu cya Bioconcentration | 6590 | pH 1;Ubushyuhe: 25 ° C. | (1) ACD |
| Ikintu cya Bioconcentration | 1.76 x 105 | pH 2;Ubushyuhe: 25 ° C. | (1) ACD |
| Ikintu cya Bioconcentration | 1.00 x 106 | pH 3;Ubushyuhe: 25 ° C. | (1) ACD |
| Ikintu cya Bioconcentration | 1.00 x 106 | pH 4;Ubushyuhe: 25 ° C. | (1) ACD |
| Ikintu cya Bioconcentration | 1.00 x 106 | pH 5;Ubushyuhe: 25 ° C. | (1) ACD |
| Ikintu cya Bioconcentration | 1.00 x 106 | pH 6;Ubushyuhe: 25 ° C. | (1) ACD |
| Ikintu cya Bioconcentration | 1.00 x 106 | pH 7;Ubushyuhe: 25 ° C. | (1) ACD |
| Ikintu cya Bioconcentration | 1.00 x 106 | pH 8;Ubushyuhe: 25 ° C. | (1) ACD |
| Ikintu cya Bioconcentration | 3.43 x 105 | pH 9;Ubushyuhe: 25 ° C. | (1) ACD |
| Ikintu cya Bioconcentration | 99100 | pH 10;Ubushyuhe: 25 ° C. | (1) ACD |
.
| Agaciro Agaciro Imiterere Inkomoko |
| Koc 2590 pH 1;Ubushyuhe: 25 ° C (1) ACD |
| Koc 69100 pH 2;Ubushyuhe: 25 ° C (1) ACD |
| Koc 6.96 x 105 pH 3;Ubushyuhe: 25 ° C (1) ACD |
| Koc 2.16 x 106 pH 4;Ubushyuhe: 25 ° C (1) ACD |
| Koc 2.70 x 106 pH 5;Ubushyuhe: 25 ° C (1) ACD |
| Koc 2.71 x 106 pH 6;Ubushyuhe: 25 ° C (1) ACD |
| Koc 2.23 x 106 pH 7;Ubushyuhe: 25 ° C (1) ACD |
| Koc 8.20 x 105 pH 8;Ubushyuhe: 25 ° C (1) ACD |
| Koc 1.35 x 105 pH 9;Ubushyuhe: 25 ° C (1) ACD |
| Koc 39000 pH 10;Ubushyuhe: 25 ° C (1) ACD |
| logD 6.29 pH 1;Ubushyuhe: 25 ° C (1) ACD |
| logD 7.71 pH 2;Ubushyuhe: 25 ° C (1) ACD |
| Umutungo | Agaciro | Imiterere | Inkomoko |
| logD | 8.71 | pH 3;Ubushyuhe: 25 ° C. | (1) ACD |
| logD | 9.20 | pH 4;Ubushyuhe: 25 ° C. | (1) ACD |
| logD | 9.30 | pH 5;Ubushyuhe: 25 ° C. | (1) ACD |
| logD | 9.30 | pH 6;Ubushyuhe: 25 ° C. | (1) ACD |
| logD | 9.22 | pH 7;Ubushyuhe: 25 ° C. | (1) ACD |
| logD | 8.79 | pH 8;Ubushyuhe: 25 ° C. | (1) ACD |
| logD | 8.00 | pH 9;Ubushyuhe: 25 ° C. | (1) ACD |
| logD | 7.46 | pH 10;Ubushyuhe: 25 ° C. | (1) ACD |
| logP | 9.317 ± 0.714 | Ubushyuhe: 25 ° C. | (1) ACD |
| Mass Massins Solubility | 3.4 x 10-6 g / L. | Ubushyuhe: 25 ° C. | (1) ACD |
| Gukemura ibibazo | 3.6 x 10-3 g / L. | pH 1;Ubushyuhe: 25 ° C. | (1) ACD |
| Gukemura ibibazo | 1.3 x 10-4 g / L. | pH 2;Ubushyuhe: 25 ° C. | (1) ACD |
| Gukemura ibibazo | 1.3 x 10-5 g / L. | pH 3;Ubushyuhe: 25 ° C. | (1) ACD |
| Gukemura ibibazo | 4.3 x 10-6 g / L. | pH 4;Ubushyuhe: 25 ° C. | (1) ACD |
| Gukemura ibibazo | 3.4 x 10-6 g / L. | pH 5;Ubushyuhe: 25 ° C. | (1) ACD |
| Gukemura ibibazo | 3.4 x 10-6 g / L. | pH 6;Ubushyuhe: 25 ° C. | (1) ACD |
| Gukemura ibibazo | 4.1 x 10-6 g / L. | pH 7;Ubushyuhe: 25 ° C. | (1) ACD |
| Gukemura ibibazo | 1.1 x 10-5 g / L. | pH 8;Ubushyuhe: 25 ° C. | (1) ACD |
| Gukemura ibibazo | 6.9 x 10-5 g / L. | pH 9;Ubushyuhe: 25 ° C. | (1) ACD |
| Gukemura ibibazo | 2.5 x 10-4 g / L. | pH 10;Ubushyuhe: 25 ° C. | (1) ACD |
| Gukemura ibibazo | 4.1 x 10-6 g / L. | Amazi adafite amazi pH 7.00;Ubushyuhe: 25 ° C. | (1) ACD |
| Molar Intrinsic Solubility | 3.9 x 10-9 mol / L. | Ubushyuhe: 25 ° C. | (1) ACD |
| Amashanyarazi | 4.1 x 10-6 mol / L. | pH 1;Ubushyuhe: 25 ° C. | (1) ACD |
| Amashanyarazi | 1.5 x 10-7 mol / L. | pH 2;Ubushyuhe: 25 ° C. | (1) ACD |
| Amashanyarazi | 1.5 x 10-8 mol / L. | pH 3;Ubushyuhe: 25 ° C. | (1) ACD |
| Amashanyarazi | 4.9 x 10-9 mol / L. | pH 4;Ubushyuhe: 25 ° C. | (1) ACD |
| Amashanyarazi | 3.9 x 10-9 mol / L. | pH 5;Ubushyuhe: 25 ° C. | (1) ACD |
| Amashanyarazi | 3.9 x 10-9 mol / L. | pH 6;Ubushyuhe: 25 ° C. | (1) ACD |
| Amashanyarazi | 4.7 x 10-9 mol / L. | pH 7;Ubushyuhe: 25 ° C. | (1) ACD |
| Amashanyarazi | 1.3 x 10-8 mol / L. | pH 8;Ubushyuhe: 25 ° C. | (1) ACD |
| Amashanyarazi | 7.9 x 10-8 mol / L. | pH 9;Ubushyuhe: 25 ° C. | (1) ACD |
| Amashanyarazi | 2.8 x 10-7 mol / L. | pH 10;Ubushyuhe: 25 ° C. | (1) ACD |
| Umutungo | Agaciro | Imiterere | Inkomoko |
| Amashanyarazi | 4.7 x 10-9 mol / L. | Amazi adafite amazi pH 7.00;Ubushyuhe: 25 ° C. | (1) ACD |
| Uburemere bwa molekile | 875.92 | ||
| pKa | 7.87 ± 0.43 | Ubushyuhe bwinshi bwa Acide: 25 ° C. | (1) ACD |
| pKa | 3.45 ± 0.70 | Ubushyuhe bwibanze: 25 ° C. | (1) ACD |
.
| Umutungo | Agaciro | Imiterere | Inkomoko |
| Impapuro zishobora guhinduka | 18 | (1) ACD | |
| H Abakira | 14 | (1) ACD | |
| H Abaterankunga | 1 | (1) ACD | |
| H Abaterankunga / Abemera Sum | 15 | (1) ACD | |
| logP | 9.317 ± 0.714 | Ubushyuhe: 25 ° C. | (1) ACD |
| Uburemere bwa molekile | 875.92 |
.
| Umutungo | Agaciro | Inkomoko |
| Ubuso bwa polarike | 169 A2 | (1) ACD |
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