3-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-5-phenyl-4H-1,2,4-triazol-4-amine
Chemical Structure Depiction of
3-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-5-phenyl-4H-1,2,4-triazol-4-amine
3-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-5-phenyl-4H-1,2,4-triazol-4-amine
Compound characteristics
| Compound ID: | 8016-7825 |
| Compound Name: | 3-{[2-(4-methoxyphenoxy)ethyl]sulfanyl}-5-phenyl-4H-1,2,4-triazol-4-amine |
| Molecular Weight: | 342.42 |
| Molecular Formula: | C17 H18 N4 O2 S |
| Smiles: | COc1ccc(cc1)OCCSc1nnc(c2ccccc2)n1N |
| Stereo: | ACHIRAL |
| logP: | 2.909 |
| logD: | 2.909 |
| logSw: | -3.1529 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.101 |
| InChI Key: | DGQPANFFQGSZGQ-UHFFFAOYSA-N |