N-(3-bromophenyl)-2-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-bromophenyl)-2-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
N-(3-bromophenyl)-2-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | F989-0015 |
| Compound Name: | N-(3-bromophenyl)-2-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 414.28 |
| Molecular Formula: | C17 H12 Br N5 O S |
| Smiles: | C(C(Nc1cccc(c1)[Br])=O)Sc1c2nncn2c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 3.5222 |
| logD: | 3.5221 |
| logSw: | -3.788 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.535 |
| InChI Key: | PHQQCTHYDHEZEF-UHFFFAOYSA-N |