3-{[2-(3-methoxyphenoxy)ethyl]sulfanyl}-5-phenyl-4H-1,2,4-triazol-4-amine
Chemical Structure Depiction of
3-{[2-(3-methoxyphenoxy)ethyl]sulfanyl}-5-phenyl-4H-1,2,4-triazol-4-amine
3-{[2-(3-methoxyphenoxy)ethyl]sulfanyl}-5-phenyl-4H-1,2,4-triazol-4-amine
Compound characteristics
| Compound ID: | 8016-7829 |
| Compound Name: | 3-{[2-(3-methoxyphenoxy)ethyl]sulfanyl}-5-phenyl-4H-1,2,4-triazol-4-amine |
| Molecular Weight: | 342.42 |
| Molecular Formula: | C17 H18 N4 O2 S |
| Smiles: | COc1cccc(c1)OCCSc1nnc(c2ccccc2)n1N |
| Stereo: | ACHIRAL |
| logP: | 2.9742 |
| logD: | 2.9742 |
| logSw: | -3.2462 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.101 |
| InChI Key: | HIIYMYQJQKGMAM-UHFFFAOYSA-N |