
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 801283-95-4 |
| Catalog No. | 2A-9092739 |
| Chinese Name | Faldaprevir |
| Synonyms | BI 201335; Faldaprevir |
| Molecular Formula | C40H49BrN6O9S |
| Molecular Weight | 869.83 |
| Density | 1.5±0.1 g/cm3 |
| Appearance | Light yellow solid |
| Storage Condition | room temperature |
| Application | Faldaprevir (BI 201335) is a potent, orally active and selective non-covalent inhibitor of the NS3/4A protease of HCV (hepatitis C virus) genotypes 1a and 1b, with Ki values of 2.6 and 2.0 nM, respe |
| PubChem ID | 74374435 |
| MDL Number | C40H49BrN6O9S |
| SMILES | C=CC1CC1(NC(=O)C1CC(Oc2cc(-c3csc(NC(=O)C(C)C)n3)nc3c(Br)c(OC)ccc23)CN1C(=O)C(NC(=O)OC1CCCC1)C(C)(C)C)C(=O)O |
| InChI | InChI=1S/C40H49BrN6O9S/c1-8-21-17-40(21,36(51)52)46-34(49)27-15-23(18-47(27)35(50)32(39(4,5)6)44-38(53)56-22-11-9-10-12-22)55-29-16-25(26-19-57-37(43-26)45-33(48)20(2)3)42-31-24(29)13-14-28(54-7)30(31)41/h8,13-14,16,19-23,27,32H,1,9-12,15,17-18H2,2-7H3,(H,44,53)(H,46,49)(H,51,52)(H,43,45,48)/t21-,23-,27+,32-,40-/m1/s1 |
| InChI Key | LLGDPTDZOVKFDU-XUHJSTDZSA-N |
| MSDS | msds/92739_1_801283_95_4.pdf |
| Transport Info | Product name: Faldaprevir |
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