N-(2-{[3-chloro-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)-2-(3-methoxyphenyl)acetamide
Chemical Structure Depiction of
N-(2-{[3-chloro-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)-2-(3-methoxyphenyl)acetamide
N-(2-{[3-chloro-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)-2-(3-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | L150-0293 |
| Compound Name: | N-(2-{[3-chloro-1-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]sulfanyl}phenyl)-2-(3-methoxyphenyl)acetamide |
| Molecular Weight: | 479 |
| Molecular Formula: | C25 H23 Cl N4 O2 S |
| Smiles: | COc1cccc(CC(Nc2ccccc2Sc2nc(nn2CCc2ccccc2)[Cl])=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.0756 |
| logD: | 5.0756 |
| logSw: | -5.2086 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.771 |
| InChI Key: | VNQIGZCQOCQZLY-UHFFFAOYSA-N |