4-methyl-5-(4-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
4-methyl-5-(4-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
4-methyl-5-(4-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 4719-0288 |
| Compound Name: | 4-methyl-5-(4-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 205.28 |
| Molecular Formula: | C10 H11 N3 S |
| Smiles: | Cc1ccc(cc1)C1=NNC(N1C)=S |
| Stereo: | ACHIRAL |
| logP: | 2.5982 |
| logD: | 1.8604 |
| logSw: | -2.7889 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.622 |
| InChI Key: | MYBRNSIBHZNBGY-UHFFFAOYSA-N |