(1-{[(2S)-1-(5-cyclopropyl-1H-pyrazole-3-carbonyl)-4,4-difluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
(1-{[(2S)-1-(5-cyclopropyl-1H-pyrazole-3-carbonyl)-4,4-difluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(pyrrolidin-1-yl)methanone
(1-{[(2S)-1-(5-cyclopropyl-1H-pyrazole-3-carbonyl)-4,4-difluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | SB36-0533 |
| Compound Name: | (1-{[(2S)-1-(5-cyclopropyl-1H-pyrazole-3-carbonyl)-4,4-difluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(pyrrolidin-1-yl)methanone |
| Molecular Weight: | 419.43 |
| Molecular Formula: | C19 H23 F2 N7 O2 |
| Smiles: | C1CCN(C1)C(c1cn(C[C@@H]2CC(CN2C(c2cc(C3CC3)[nH]n2)=O)(F)F)nn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.6271 |
| logD: | 1.6271 |
| logSw: | -2.1548 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.373 |
| InChI Key: | IZKHHUPAGSUEMK-CYBMUJFWSA-N |