N-(4-bromo-2-fluorophenyl)-2-({2-[2-(2-methyl-1H-benzimidazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(4-bromo-2-fluorophenyl)-2-({2-[2-(2-methyl-1H-benzimidazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)acetamide
N-(4-bromo-2-fluorophenyl)-2-({2-[2-(2-methyl-1H-benzimidazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | K280-0415 |
| Compound Name: | N-(4-bromo-2-fluorophenyl)-2-({2-[2-(2-methyl-1H-benzimidazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)acetamide |
| Molecular Weight: | 590.48 |
| Molecular Formula: | C27 H21 Br F N7 O S |
| Smiles: | Cc1nc2ccccc2n1CCc1nc2c3ccccc3nc(n2n1)SCC(Nc1ccc(cc1F)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.5063 |
| logD: | 5.3831 |
| logSw: | -5.6216 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.195 |
| InChI Key: | IBWPRHQZWKAIEV-UHFFFAOYSA-N |