ethyl 4-({[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-({[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)piperazine-1-carboxylate
ethyl 4-({[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)piperazine-1-carboxylate
Compound characteristics
| Compound ID: | D419-0084 |
| Compound Name: | ethyl 4-({[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)piperazine-1-carboxylate |
| Molecular Weight: | 481.57 |
| Molecular Formula: | C24 H27 N5 O4 S |
| Smiles: | CCOC(N1CCN(CC1)C(CSc1nnc(c2ccc(cc2)OC)n1c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.449 |
| logD: | 3.449 |
| logSw: | -3.518 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.429 |
| InChI Key: | CDPMQIUSAWDEKA-UHFFFAOYSA-N |