methyl 4-({1-(4-chlorophenyl)-2-[4-(phenylmethanesulfonyl)piperazin-1-yl]ethoxy}methyl)benzoate
Chemical Structure Depiction of
methyl 4-({1-(4-chlorophenyl)-2-[4-(phenylmethanesulfonyl)piperazin-1-yl]ethoxy}methyl)benzoate
methyl 4-({1-(4-chlorophenyl)-2-[4-(phenylmethanesulfonyl)piperazin-1-yl]ethoxy}methyl)benzoate
Compound characteristics
| Compound ID: | V006-0645 |
| Compound Name: | methyl 4-({1-(4-chlorophenyl)-2-[4-(phenylmethanesulfonyl)piperazin-1-yl]ethoxy}methyl)benzoate |
| Molecular Weight: | 543.08 |
| Molecular Formula: | C28 H31 Cl N2 O5 S |
| Salt: | not_available |
| Smiles: | COC(c1ccc(COC(CN2CCN(CC2)S(Cc2ccccc2)(=O)=O)c2ccc(cc2)[Cl])cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3996 |
| logD: | 4.3986 |
| logSw: | -4.846 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 63.438 |
| InChI Key: | USVOZQCEKSQJOQ-MHZLTWQESA-N |