2-({[4-(4-fluorophenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(2-methoxyethyl)benzamide
Chemical Structure Depiction of
2-({[4-(4-fluorophenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(2-methoxyethyl)benzamide
2-({[4-(4-fluorophenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(2-methoxyethyl)benzamide
Compound characteristics
| Compound ID: | V029-3805 |
| Compound Name: | 2-({[4-(4-fluorophenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(2-methoxyethyl)benzamide |
| Molecular Weight: | 463.53 |
| Molecular Formula: | C24 H22 F N5 O2 S |
| Salt: | not_available |
| Smiles: | COCCNC(c1ccccc1CSc1nnc(c2cccnc2)n1c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4569 |
| logD: | 3.4527 |
| logSw: | -3.6064 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.099 |
| InChI Key: | JKJMHBAJRUQESY-UHFFFAOYSA-N |