methyl 4-chloro-2-{(1-ethylpiperidin-4-yl)[(4-fluorophenyl)methyl]carbamamido}benzoate
Chemical Structure Depiction of
methyl 4-chloro-2-{(1-ethylpiperidin-4-yl)[(4-fluorophenyl)methyl]carbamamido}benzoate
methyl 4-chloro-2-{(1-ethylpiperidin-4-yl)[(4-fluorophenyl)methyl]carbamamido}benzoate
Compound characteristics
| Compound ID: | E641-3694 |
| Compound Name: | methyl 4-chloro-2-{(1-ethylpiperidin-4-yl)[(4-fluorophenyl)methyl]carbamamido}benzoate |
| Molecular Weight: | 447.94 |
| Molecular Formula: | C23 H27 Cl F N3 O3 |
| Smiles: | CCN1CCC(CC1)N(Cc1ccc(cc1)F)C(Nc1cc(ccc1C(=O)OC)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5621 |
| logD: | 2.6351 |
| logSw: | -4.5841 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.256 |
| InChI Key: | KGRZXGHVUSMUQK-UHFFFAOYSA-N |