3-{[(3-chloro-4-methoxyphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-4-amine
Chemical Structure Depiction of
3-{[(3-chloro-4-methoxyphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-4-amine
3-{[(3-chloro-4-methoxyphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-4-amine
Compound characteristics
| Compound ID: | 4298-0287 |
| Compound Name: | 3-{[(3-chloro-4-methoxyphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-4-amine |
| Molecular Weight: | 270.74 |
| Molecular Formula: | C10 H11 Cl N4 O S |
| Smiles: | COc1ccc(CSc2nncn2N)cc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.4345 |
| logD: | 1.4345 |
| logSw: | -2.6233 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.216 |
| InChI Key: | JXASMDXZRAIFDU-UHFFFAOYSA-N |