N-cyclopropyl-2-({[4-(4-fluorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Chemical Structure Depiction of
N-cyclopropyl-2-({[4-(4-fluorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
N-cyclopropyl-2-({[4-(4-fluorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Compound characteristics
| Compound ID: | V029-8180 |
| Compound Name: | N-cyclopropyl-2-({[4-(4-fluorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide |
| Molecular Weight: | 382.46 |
| Molecular Formula: | C20 H19 F N4 O S |
| Smiles: | Cc1nnc(n1c1ccc(cc1)F)SCc1ccccc1C(NC1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2519 |
| logD: | 3.2518 |
| logSw: | -3.7146 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.231 |
| InChI Key: | CUIJQPLUOYTIFW-UHFFFAOYSA-N |