methyl 4-{[1-(4-chlorophenyl)-2-{4-[(2RS)-2-phenylcyclopropane-1-carbonyl]piperazin-1-yl}ethoxy]methyl}benzoate
Chemical Structure Depiction of
methyl 4-{[1-(4-chlorophenyl)-2-{4-[(2RS)-2-phenylcyclopropane-1-carbonyl]piperazin-1-yl}ethoxy]methyl}benzoate
methyl 4-{[1-(4-chlorophenyl)-2-{4-[(2RS)-2-phenylcyclopropane-1-carbonyl]piperazin-1-yl}ethoxy]methyl}benzoate
Compound characteristics
| Compound ID: | V013-7453 |
| Compound Name: | methyl 4-{[1-(4-chlorophenyl)-2-{4-[(2RS)-2-phenylcyclopropane-1-carbonyl]piperazin-1-yl}ethoxy]methyl}benzoate |
| Molecular Weight: | 533.07 |
| Molecular Formula: | C31 H33 Cl N2 O4 |
| Salt: | not_available |
| Smiles: | COC(c1ccc(COC(CN2CCN(CC2)C(C2C[C@H]2c2ccccc2)=O)c2ccc(cc2)[Cl])cc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.4084 |
| logD: | 5.3988 |
| logSw: | -6.2209 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.733 |
| InChI Key: | SYXPLZTUGBLQHM-VSPYUBNUSA-N |