5-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-4H-1,2,4-triazole-3-thiol
5-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8012-2479 |
| Compound Name: | 5-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 269.75 |
| Molecular Formula: | C11 H12 Cl N3 O S |
| Smiles: | Cc1cc(ccc1[Cl])OCc1nnc(n1C)S |
| Stereo: | ACHIRAL |
| logP: | 2.4413 |
| logD: | 2.0169 |
| logSw: | -3.0223 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.271 |
| InChI Key: | XOSWEMQNUIVMSL-UHFFFAOYSA-N |