[1-({(2S)-4,4-difluoro-1-[(3-phenyl-1H-pyrazol-4-yl)methyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazol-4-yl](pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
[1-({(2S)-4,4-difluoro-1-[(3-phenyl-1H-pyrazol-4-yl)methyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazol-4-yl](pyrrolidin-1-yl)methanone
[1-({(2S)-4,4-difluoro-1-[(3-phenyl-1H-pyrazol-4-yl)methyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazol-4-yl](pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | SB36-0542 |
| Compound Name: | [1-({(2S)-4,4-difluoro-1-[(3-phenyl-1H-pyrazol-4-yl)methyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazol-4-yl](pyrrolidin-1-yl)methanone |
| Molecular Weight: | 441.48 |
| Molecular Formula: | C22 H25 F2 N7 O |
| Smiles: | C1CCN(C1)C(c1cn(C[C@@H]2CC(CN2Cc2c[nH]nc2c2ccccc2)(F)F)nn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.1592 |
| logD: | 2.1557 |
| logSw: | -2.4993 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.8 |
| InChI Key: | JNQQZHXLKWKWPO-GOSISDBHSA-N |