(1-{[(2S)-4,4-difluoro-1-(oxane-4-carbonyl)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-(oxane-4-carbonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(pyrrolidin-1-yl)methanone
(1-{[(2S)-4,4-difluoro-1-(oxane-4-carbonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | SB36-0585 |
| Compound Name: | (1-{[(2S)-4,4-difluoro-1-(oxane-4-carbonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(pyrrolidin-1-yl)methanone |
| Molecular Weight: | 397.42 |
| Molecular Formula: | C18 H25 F2 N5 O3 |
| Smiles: | C1CCN(C1)C(c1cn(C[C@@H]2CC(CN2C(C2CCOCC2)=O)(F)F)nn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.89 |
| logD: | 0.89 |
| logSw: | -0.6254 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 68.461 |
| InChI Key: | SGSDKFFWPLXQEA-CQSZACIVSA-N |