N-{2-[(3-bromo-1-ethyl-1H-1,2,4-triazol-5-yl)sulfanyl]phenyl}acetamide
Chemical Structure Depiction of
N-{2-[(3-bromo-1-ethyl-1H-1,2,4-triazol-5-yl)sulfanyl]phenyl}acetamide
N-{2-[(3-bromo-1-ethyl-1H-1,2,4-triazol-5-yl)sulfanyl]phenyl}acetamide
Compound characteristics
| Compound ID: | F938-0487 |
| Compound Name: | N-{2-[(3-bromo-1-ethyl-1H-1,2,4-triazol-5-yl)sulfanyl]phenyl}acetamide |
| Molecular Weight: | 341.23 |
| Molecular Formula: | C12 H13 Br N4 O S |
| Smiles: | CCn1c(nc(n1)[Br])Sc1ccccc1NC(C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0372 |
| logD: | 2.0372 |
| logSw: | -2.5884 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.595 |
| InChI Key: | GLPUJSSTRNAYSB-UHFFFAOYSA-N |