2-({[5-benzyl-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-cyclopropylbenzamide
Chemical Structure Depiction of
2-({[5-benzyl-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-cyclopropylbenzamide
2-({[5-benzyl-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-cyclopropylbenzamide
Compound characteristics
| Compound ID: | V004-8591 |
| Compound Name: | 2-({[5-benzyl-4-(2-methoxyethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-cyclopropylbenzamide |
| Molecular Weight: | 422.55 |
| Molecular Formula: | C23 H26 N4 O2 S |
| Smiles: | COCCn1c(Cc2ccccc2)nnc1SCc1ccccc1C(NC1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6197 |
| logD: | 3.6197 |
| logSw: | -3.72 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.007 |
| InChI Key: | ITUNGRIXOIEMMK-UHFFFAOYSA-N |