N-(2-methoxyethyl)-2-({[4-(3-methylphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Chemical Structure Depiction of
N-(2-methoxyethyl)-2-({[4-(3-methylphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
N-(2-methoxyethyl)-2-({[4-(3-methylphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Compound characteristics
| Compound ID: | V026-6753 |
| Compound Name: | N-(2-methoxyethyl)-2-({[4-(3-methylphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide |
| Molecular Weight: | 459.57 |
| Molecular Formula: | C25 H25 N5 O2 S |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)n1c(c2cccnc2)nnc1SCc1ccccc1C(NCCOC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8955 |
| logD: | 3.8913 |
| logSw: | -3.7639 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.099 |
| InChI Key: | KDQNXAIYWDKNRY-UHFFFAOYSA-N |