methyl 4-(4-{2-(4-chlorophenyl)-2-[(2,6-difluorophenyl)methoxy]ethyl}piperazine-1-carbonyl)benzoate
Chemical Structure Depiction of
methyl 4-(4-{2-(4-chlorophenyl)-2-[(2,6-difluorophenyl)methoxy]ethyl}piperazine-1-carbonyl)benzoate
methyl 4-(4-{2-(4-chlorophenyl)-2-[(2,6-difluorophenyl)methoxy]ethyl}piperazine-1-carbonyl)benzoate
Compound characteristics
| Compound ID: | V002-1908 |
| Compound Name: | methyl 4-(4-{2-(4-chlorophenyl)-2-[(2,6-difluorophenyl)methoxy]ethyl}piperazine-1-carbonyl)benzoate |
| Molecular Weight: | 528.98 |
| Molecular Formula: | C28 H27 Cl F2 N2 O4 |
| Salt: | not_available |
| Smiles: | COC(c1ccc(cc1)C(N1CCN(CC1)CC(c1ccc(cc1)[Cl])OCc1c(cccc1F)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7867 |
| logD: | 4.7839 |
| logSw: | -5.2013 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.481 |
| InChI Key: | KBEWKRRPYWRVIX-SANMLTNESA-N |