methyl 4-({2-[4-(3-chloro-2-fluorobenzene-1-sulfonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate
Chemical Structure Depiction of
methyl 4-({2-[4-(3-chloro-2-fluorobenzene-1-sulfonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate
methyl 4-({2-[4-(3-chloro-2-fluorobenzene-1-sulfonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate
Compound characteristics
Compound ID: | V008-5312 |
Compound Name: | methyl 4-({2-[4-(3-chloro-2-fluorobenzene-1-sulfonyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethoxy}methyl)benzoate |
Molecular Weight: | 577.07 |
Molecular Formula: | C28 H30 Cl F N2 O6 S |
Salt: | not_available |
Smiles: | COC(c1ccc(COC(CN2CCN(CC2)S(c2cccc(c2F)[Cl])(=O)=O)c2cccc(c2)OC)cc1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.8835 |
logD: | 4.8829 |
logSw: | -5.0357 |
Hydrogen bond acceptors count: | 11 |
Polar surface area: | 71.088 |
InChI Key: | LNEVKBZNQGLNOO-VWLOTQADSA-N |