2-{[4-ethyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-{[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}acetamide
Chemical Structure Depiction of
2-{[4-ethyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-{[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}acetamide
2-{[4-ethyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-{[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}acetamide
Compound characteristics
| Compound ID: | 8017-8531 |
| Compound Name: | 2-{[4-ethyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-{[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}acetamide |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C24 H27 N5 O2 S |
| Smiles: | CCn1c(c2ccc(C)cc2)nnc1SCC(NCc1ccc(cc1)N1CCCC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7209 |
| logD: | 3.7209 |
| logSw: | -3.7726 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.253 |
| InChI Key: | GCOHKKIWUKJLLS-UHFFFAOYSA-N |