N-(4-bromophenyl)-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
N-(4-bromophenyl)-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 8012-4101 |
| Compound Name: | N-(4-bromophenyl)-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 313.17 |
| Molecular Formula: | C10 H9 Br N4 O S |
| Smiles: | C(C(Nc1ccc(cc1)[Br])=O)Sc1nnc[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 1.573 |
| logD: | 1.2185 |
| logSw: | -2.3074 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.542 |
| InChI Key: | BXSUMOOBFDWLAI-UHFFFAOYSA-N |