N-[(4-ethylphenyl)methyl]-1-[4-(methylsulfanyl)phenyl]-5-(pyridin-2-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-[(4-ethylphenyl)methyl]-1-[4-(methylsulfanyl)phenyl]-5-(pyridin-2-yl)-1H-1,2,3-triazole-4-carboxamide
N-[(4-ethylphenyl)methyl]-1-[4-(methylsulfanyl)phenyl]-5-(pyridin-2-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | P016-4156 |
| Compound Name: | N-[(4-ethylphenyl)methyl]-1-[4-(methylsulfanyl)phenyl]-5-(pyridin-2-yl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 429.54 |
| Molecular Formula: | C24 H23 N5 O S |
| Smiles: | CCc1ccc(CNC(c2c(c3ccccn3)n(c3ccc(cc3)SC)nn2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6563 |
| logD: | 4.6562 |
| logSw: | -4.2799 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.3 |
| InChI Key: | CBSGDQFFICCOFO-UHFFFAOYSA-N |