N-(4-bromo-3-methylphenyl)-2-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(4-bromo-3-methylphenyl)-2-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
N-(4-bromo-3-methylphenyl)-2-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | F989-0052 |
| Compound Name: | N-(4-bromo-3-methylphenyl)-2-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 428.31 |
| Molecular Formula: | C18 H14 Br N5 O S |
| Smiles: | Cc1cc(ccc1[Br])NC(CSc1c2nncn2c2ccccc2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8887 |
| logD: | 3.8887 |
| logSw: | -3.8954 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.535 |
| InChI Key: | BVOPJPKXOMDEGP-UHFFFAOYSA-N |