2-[(8-bromo-5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)acetamide
Chemical Structure Depiction of
2-[(8-bromo-5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)acetamide
2-[(8-bromo-5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | Y501-1135 |
| Compound Name: | 2-[(8-bromo-5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)acetamide |
| Molecular Weight: | 525.45 |
| Molecular Formula: | C22 H17 Br N6 O S2 |
| Smiles: | Cc1c(c2ccccc2)nc(NC(CSc2nc3c(c4cc(ccc4n3C)[Br])nn2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.1438 |
| logD: | 5.1436 |
| logSw: | -5.0788 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.483 |
| InChI Key: | CSYBPZGVXMJQIE-UHFFFAOYSA-N |