1-[(2S)-4,4-difluoro-2-{[4-(morpholine-4-carbonyl)-1H-1,2,3-triazol-1-yl]methyl}pyrrolidin-1-yl]-2-methoxyethan-1-one
Chemical Structure Depiction of
1-[(2S)-4,4-difluoro-2-{[4-(morpholine-4-carbonyl)-1H-1,2,3-triazol-1-yl]methyl}pyrrolidin-1-yl]-2-methoxyethan-1-one
1-[(2S)-4,4-difluoro-2-{[4-(morpholine-4-carbonyl)-1H-1,2,3-triazol-1-yl]methyl}pyrrolidin-1-yl]-2-methoxyethan-1-one
Compound characteristics
| Compound ID: | SB36-0636 |
| Compound Name: | 1-[(2S)-4,4-difluoro-2-{[4-(morpholine-4-carbonyl)-1H-1,2,3-triazol-1-yl]methyl}pyrrolidin-1-yl]-2-methoxyethan-1-one |
| Molecular Weight: | 373.36 |
| Molecular Formula: | C15 H21 F2 N5 O4 |
| Smiles: | COCC(N1CC(C[C@H]1Cn1cc(C(N2CCOCC2)=O)nn1)(F)F)=O |
| Stereo: | ABSOLUTE |
| logP: | -0.8551 |
| logD: | -0.8551 |
| logSw: | -0.0625 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 76.07 |
| InChI Key: | IUWNARUEMCOUNC-LLVKDONJSA-N |