1-{2-[5-(3,4-difluorophenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl}butan-1-one
Chemical Structure Depiction of
1-{2-[5-(3,4-difluorophenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl}butan-1-one
1-{2-[5-(3,4-difluorophenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl}butan-1-one
Compound characteristics
| Compound ID: | V001-3453 |
| Compound Name: | 1-{2-[5-(3,4-difluorophenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl}butan-1-one |
| Molecular Weight: | 370.4 |
| Molecular Formula: | C21 H20 F2 N2 O2 |
| Smiles: | CCCC(N1CCCC1c1nc2cc(ccc2o1)c1ccc(c(c1)F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2175 |
| logD: | 5.2175 |
| logSw: | -5.0901 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.229 |
| InChI Key: | XBCOBPBWDTULQX-SFHVURJKSA-N |