
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 1417333-83-5 |
| Catalog No. | 2A-3180706 |
| Chinese Name | 达卡他韦杂质 01 |
| Synonyms | InChIKey FKRSSPOQAMALKA-GZXHTMMISA-N; Synonyms |
| Molecular Formula | C40H50N8O6 |
| Molecular Weight | 738.88 |
| Density | 1.249±0.06 g/cm3 (20 ºC 760 Torr) |
| Water Solubility | Virtually insoluble (0.029 g/L) (25 ºC) |
| PubChem ID | 53784711 |
| SMILES | COC(=O)NC(C(=O)N1CCCC1c1ncc(-c2ccc(-c3ccc(-c4cnc(C5CCCN5C(=O)C(NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C |
| InChI | InChI=1S/C40H50N8O6/c1-23(2)33(45-39(51)53-5)37(49)47-19-7-9-31(47)35-41-21-29(43-35)27-15-11-25(12-16-27)26-13-17-28(18-14-26)30-22-42-36(44-30)32-10-8-20-48(32)38(50)34(24(3)4)46-40(52)54-6/h11-18,21-24,31-34H,7-10,19-20H2,1-6H3,(H,41,43)(H,42,44)(H,45,51)(H,46,52)/t31-,32-,33-,34+/m0/s1 |
| InChI Key | FKRSSPOQAMALKA-GZXHTMMISA-N |
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