methyl 4-({2-[4-(3-chloro-4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-1-(4-chlorophenyl)ethoxy}methyl)benzoate
Chemical Structure Depiction of
methyl 4-({2-[4-(3-chloro-4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-1-(4-chlorophenyl)ethoxy}methyl)benzoate
methyl 4-({2-[4-(3-chloro-4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-1-(4-chlorophenyl)ethoxy}methyl)benzoate
Compound characteristics
| Compound ID: | V001-2508 |
| Compound Name: | methyl 4-({2-[4-(3-chloro-4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-1-(4-chlorophenyl)ethoxy}methyl)benzoate |
| Molecular Weight: | 581.49 |
| Molecular Formula: | C27 H27 Cl2 F N2 O5 S |
| Salt: | not_available |
| Smiles: | COC(c1ccc(COC(CN2CCN(CC2)S(c2ccc(c(c2)[Cl])F)(=O)=O)c2ccc(cc2)[Cl])cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2962 |
| logD: | 5.2949 |
| logSw: | -6.0323 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 63.544 |
| InChI Key: | MXRBYNIQJPAFBU-SANMLTNESA-N |