[2-({[5-benzyl-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
[2-({[5-benzyl-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
[2-({[5-benzyl-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | V026-5513 |
| Compound Name: | [2-({[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(c1ccccc1CSc1nnc(Cc2ccccc2)n1c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0341 |
| logD: | 5.0341 |
| logSw: | -4.8923 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.703 |
| InChI Key: | SMFMWAHFSVIYAM-UHFFFAOYSA-N |