3-{[(4-fluorophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-4-amine
Chemical Structure Depiction of
3-{[(4-fluorophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-4-amine
3-{[(4-fluorophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-4-amine
Compound characteristics
| Compound ID: | 3630-0402 |
| Compound Name: | 3-{[(4-fluorophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-4-amine |
| Molecular Weight: | 224.26 |
| Molecular Formula: | C9 H9 F N4 S |
| Smiles: | C(c1ccc(cc1)F)Sc1nncn1N |
| Stereo: | ACHIRAL |
| logP: | 0.8326 |
| logD: | 0.8326 |
| logSw: | -1.316 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.586 |
| InChI Key: | JLCBZRKYKMEHMS-UHFFFAOYSA-N |