methyl 3-[1-(3,4-difluorobenzoyl)piperidin-4-yl]-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxylate
Chemical Structure Depiction of
methyl 3-[1-(3,4-difluorobenzoyl)piperidin-4-yl]-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxylate
methyl 3-[1-(3,4-difluorobenzoyl)piperidin-4-yl]-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxylate
Compound characteristics
| Compound ID: | V012-1727 |
| Compound Name: | methyl 3-[1-(3,4-difluorobenzoyl)piperidin-4-yl]-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxylate |
| Molecular Weight: | 416.38 |
| Molecular Formula: | C21 H18 F2 N2 O5 |
| Smiles: | COC(c1ccc2c(c1)N(C1CCN(CC1)C(c1ccc(c(c1)F)F)=O)C(=O)O2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.199 |
| logD: | 3.199 |
| logSw: | -3.4982 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.919 |
| InChI Key: | DYSJRLFSDQQKPQ-UHFFFAOYSA-N |