3-chloro-1-{2-[5-(3,4-difluorophenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl}-2,2-dimethylpropan-1-one
Chemical Structure Depiction of
3-chloro-1-{2-[5-(3,4-difluorophenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl}-2,2-dimethylpropan-1-one
3-chloro-1-{2-[5-(3,4-difluorophenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl}-2,2-dimethylpropan-1-one
Compound characteristics
| Compound ID: | V005-3599 |
| Compound Name: | 3-chloro-1-{2-[5-(3,4-difluorophenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl}-2,2-dimethylpropan-1-one |
| Molecular Weight: | 418.87 |
| Molecular Formula: | C22 H21 Cl F2 N2 O2 |
| Smiles: | CC(C)(C[Cl])C(N1CCCC1c1nc2cc(ccc2o1)c1ccc(c(c1)F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7329 |
| logD: | 5.7329 |
| logSw: | -5.6149 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.757 |
| InChI Key: | ALMFIHXRFOANJC-SFHVURJKSA-N |