methyl 4-({1-(4-chlorophenyl)-2-[4-(2-phenylbutanoyl)piperazin-1-yl]ethoxy}methyl)benzoate
Chemical Structure Depiction of
methyl 4-({1-(4-chlorophenyl)-2-[4-(2-phenylbutanoyl)piperazin-1-yl]ethoxy}methyl)benzoate
methyl 4-({1-(4-chlorophenyl)-2-[4-(2-phenylbutanoyl)piperazin-1-yl]ethoxy}methyl)benzoate
Compound characteristics
| Compound ID: | V008-6007 |
| Compound Name: | methyl 4-({1-(4-chlorophenyl)-2-[4-(2-phenylbutanoyl)piperazin-1-yl]ethoxy}methyl)benzoate |
| Molecular Weight: | 535.08 |
| Molecular Formula: | C31 H35 Cl N2 O4 |
| Salt: | not_available |
| Smiles: | CCC(C(N1CCN(CC1)CC(c1ccc(cc1)[Cl])OCc1ccc(cc1)C(=O)OC)=O)c1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.7066 |
| logD: | 5.6981 |
| logSw: | -6.2014 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.481 |
| InChI Key: | DFFKGQKBILLJIB-UHFFFAOYSA-N |