{2-[2-(4-benzyl-4H-1,2,4-triazol-3-yl)ethyl]pyrrolidin-1-yl}(5-chloro-2-fluorophenyl)methanone
Chemical Structure Depiction of
{2-[2-(4-benzyl-4H-1,2,4-triazol-3-yl)ethyl]pyrrolidin-1-yl}(5-chloro-2-fluorophenyl)methanone
{2-[2-(4-benzyl-4H-1,2,4-triazol-3-yl)ethyl]pyrrolidin-1-yl}(5-chloro-2-fluorophenyl)methanone
Compound characteristics
| Compound ID: | SD73-0515 |
| Compound Name: | {2-[2-(4-benzyl-4H-1,2,4-triazol-3-yl)ethyl]pyrrolidin-1-yl}(5-chloro-2-fluorophenyl)methanone |
| Molecular Weight: | 412.89 |
| Molecular Formula: | C22 H22 Cl F N4 O |
| Smiles: | C1CC(CCc2nncn2Cc2ccccc2)N(C1)C(c1cc(ccc1F)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7428 |
| logD: | 3.7428 |
| logSw: | -4.2689 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.96 |
| InChI Key: | NFKAGQCASBCDCV-GOSISDBHSA-N |