5-(4-bromophenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
5-(4-bromophenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
5-(4-bromophenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 5865-4146 |
| Compound Name: | 5-(4-bromophenyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 270.15 |
| Molecular Formula: | C9 H8 Br N3 S |
| Smiles: | CN1C(c2ccc(cc2)[Br])=NNC1=S |
| Stereo: | ACHIRAL |
| logP: | 3.0087 |
| logD: | 2.2709 |
| logSw: | -3.1469 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.622 |
| InChI Key: | FHXAECCDIGEICD-UHFFFAOYSA-N |