3-{[(3-bromophenyl)methyl]sulfanyl}-5-phenyl-4H-1,2,4-triazol-4-amine
Chemical Structure Depiction of
3-{[(3-bromophenyl)methyl]sulfanyl}-5-phenyl-4H-1,2,4-triazol-4-amine
3-{[(3-bromophenyl)methyl]sulfanyl}-5-phenyl-4H-1,2,4-triazol-4-amine
Compound characteristics
| Compound ID: | 8011-5935 |
| Compound Name: | 3-{[(3-bromophenyl)methyl]sulfanyl}-5-phenyl-4H-1,2,4-triazol-4-amine |
| Molecular Weight: | 361.26 |
| Molecular Formula: | C15 H13 Br N4 S |
| Smiles: | C(c1cccc(c1)[Br])Sc1nnc(c2ccccc2)n1N |
| Stereo: | ACHIRAL |
| logP: | 3.7624 |
| logD: | 3.7624 |
| logSw: | -4.2031 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.139 |
| InChI Key: | IGNCEHHTJXSIHU-UHFFFAOYSA-N |