[4-({[5-benzyl-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
[4-({[5-benzyl-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
[4-({[5-benzyl-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | V016-0125 |
| Compound Name: | [4-({[5-benzyl-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone |
| Molecular Weight: | 472.58 |
| Molecular Formula: | C27 H25 F N4 O S |
| Salt: | not_available |
| Smiles: | C1CCN(C1)C(c1ccc(CSc2nnc(Cc3ccccc3)n2c2ccc(cc2)F)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3988 |
| logD: | 4.3988 |
| logSw: | -4.3752 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.703 |
| InChI Key: | CNMVLQYVKYFBPJ-UHFFFAOYSA-N |