methyl 4-({1-(4-chlorophenyl)-2-[4-(2,6-difluorobenzoyl)piperazin-1-yl]ethoxy}methyl)benzoate
Chemical Structure Depiction of
methyl 4-({1-(4-chlorophenyl)-2-[4-(2,6-difluorobenzoyl)piperazin-1-yl]ethoxy}methyl)benzoate
methyl 4-({1-(4-chlorophenyl)-2-[4-(2,6-difluorobenzoyl)piperazin-1-yl]ethoxy}methyl)benzoate
Compound characteristics
| Compound ID: | V003-2502 |
| Compound Name: | methyl 4-({1-(4-chlorophenyl)-2-[4-(2,6-difluorobenzoyl)piperazin-1-yl]ethoxy}methyl)benzoate |
| Molecular Weight: | 528.98 |
| Molecular Formula: | C28 H27 Cl F2 N2 O4 |
| Salt: | not_available |
| Smiles: | COC(c1ccc(COC(CN2CCN(CC2)C(c2c(cccc2F)F)=O)c2ccc(cc2)[Cl])cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7742 |
| logD: | 4.7715 |
| logSw: | -5.3517 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.481 |
| InChI Key: | CPQBRAGYFSITLQ-VWLOTQADSA-N |