3-{3-[(2S)-4,4-difluoro-2-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl]-3-oxopropyl}-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-{3-[(2S)-4,4-difluoro-2-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl]-3-oxopropyl}-1,3-benzoxazol-2(3H)-one
3-{3-[(2S)-4,4-difluoro-2-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl]-3-oxopropyl}-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | CM4572-4472 |
| Compound Name: | 3-{3-[(2S)-4,4-difluoro-2-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl]-3-oxopropyl}-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 393.39 |
| Molecular Formula: | C19 H21 F2 N3 O4 |
| Smiles: | C1CCN(C1)C([C@@H]1CC(CN1C(CCN1C(=O)Oc2ccccc12)=O)(F)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.8274 |
| logD: | 1.8274 |
| logSw: | -2.2463 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.445 |
| InChI Key: | DSWUVVRJTNXYEU-CQSZACIVSA-N |