2-({[4-(4-fluorophenyl)-5-(methoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(2-methylpropyl)benzamide
Chemical Structure Depiction of
2-({[4-(4-fluorophenyl)-5-(methoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(2-methylpropyl)benzamide
2-({[4-(4-fluorophenyl)-5-(methoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(2-methylpropyl)benzamide
Compound characteristics
| Compound ID: | V027-6901 |
| Compound Name: | 2-({[4-(4-fluorophenyl)-5-(methoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(2-methylpropyl)benzamide |
| Molecular Weight: | 428.53 |
| Molecular Formula: | C22 H25 F N4 O2 S |
| Salt: | not_available |
| Smiles: | CC(C)CNC(c1ccccc1CSc1nnc(COC)n1c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8015 |
| logD: | 3.8015 |
| logSw: | -3.9555 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.069 |
| InChI Key: | QBJQEJSVPQDRPG-UHFFFAOYSA-N |