2-{[5-(3-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
Chemical Structure Depiction of
2-{[5-(3-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
2-{[5-(3-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
Compound characteristics
| Compound ID: | 8006-7049 |
| Compound Name: | 2-{[5-(3-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide |
| Molecular Weight: | 507.45 |
| Molecular Formula: | C25 H23 Br N4 O S |
| Smiles: | CC(C)c1ccc(cc1)NC(CSc1nnc(c2cccc(c2)[Br])n1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.8513 |
| logD: | 6.8513 |
| logSw: | -5.6082 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.862 |
| InChI Key: | ADLUJFZXICCUSB-UHFFFAOYSA-N |