methyl 4-({2-[4-(1-benzothiophene-2-carbonyl)piperazin-1-yl]-1-(4-chlorophenyl)ethoxy}methyl)benzoate
Chemical Structure Depiction of
methyl 4-({2-[4-(1-benzothiophene-2-carbonyl)piperazin-1-yl]-1-(4-chlorophenyl)ethoxy}methyl)benzoate
methyl 4-({2-[4-(1-benzothiophene-2-carbonyl)piperazin-1-yl]-1-(4-chlorophenyl)ethoxy}methyl)benzoate
Compound characteristics
| Compound ID: | V003-2477 |
| Compound Name: | methyl 4-({2-[4-(1-benzothiophene-2-carbonyl)piperazin-1-yl]-1-(4-chlorophenyl)ethoxy}methyl)benzoate |
| Molecular Weight: | 549.09 |
| Molecular Formula: | C30 H29 Cl N2 O4 S |
| Salt: | not_available |
| Smiles: | COC(c1ccc(COC(CN2CCN(CC2)C(c2cc3ccccc3s2)=O)c2ccc(cc2)[Cl])cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.093 |
| logD: | 6.0904 |
| logSw: | -6.4845 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.228 |
| InChI Key: | LOFDEMHRTMZXOR-SANMLTNESA-N |