N-{2-[(3-bromo-1-ethyl-1H-1,2,4-triazol-5-yl)sulfanyl]phenyl}-2-methylpropanamide
Chemical Structure Depiction of
N-{2-[(3-bromo-1-ethyl-1H-1,2,4-triazol-5-yl)sulfanyl]phenyl}-2-methylpropanamide
N-{2-[(3-bromo-1-ethyl-1H-1,2,4-triazol-5-yl)sulfanyl]phenyl}-2-methylpropanamide
Compound characteristics
| Compound ID: | F938-0491 |
| Compound Name: | N-{2-[(3-bromo-1-ethyl-1H-1,2,4-triazol-5-yl)sulfanyl]phenyl}-2-methylpropanamide |
| Molecular Weight: | 369.28 |
| Molecular Formula: | C14 H17 Br N4 O S |
| Smiles: | CCn1c(nc(n1)[Br])Sc1ccccc1NC(C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4483 |
| logD: | 3.4483 |
| logSw: | -3.6236 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.696 |
| InChI Key: | YOBLHGZPNYFXEM-UHFFFAOYSA-N |