4-ethoxy-N-{[4-(5-phenyl-1H-1,2,3-triazol-1-yl)phenyl]carbamothioyl}benzamide
Chemical Structure Depiction of
4-ethoxy-N-{[4-(5-phenyl-1H-1,2,3-triazol-1-yl)phenyl]carbamothioyl}benzamide
4-ethoxy-N-{[4-(5-phenyl-1H-1,2,3-triazol-1-yl)phenyl]carbamothioyl}benzamide
Compound characteristics
| Compound ID: | K415-0368 |
| Compound Name: | 4-ethoxy-N-{[4-(5-phenyl-1H-1,2,3-triazol-1-yl)phenyl]carbamothioyl}benzamide |
| Molecular Weight: | 443.53 |
| Molecular Formula: | C24 H21 N5 O2 S |
| Smiles: | CCOc1ccc(cc1)C(NC(Nc1ccc(cc1)n1c(cnn1)c1ccccc1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0358 |
| logD: | 5.0355 |
| logSw: | -4.3802 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.348 |
| InChI Key: | WCWXBMQPUXHQTD-UHFFFAOYSA-N |