N-[(2-chlorophenyl)methyl]-4-{2-[(4-cyanophenyl)methoxy]-2-(3-methoxyphenyl)ethyl}piperazine-1-carboxamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-4-{2-[(4-cyanophenyl)methoxy]-2-(3-methoxyphenyl)ethyl}piperazine-1-carboxamide
N-[(2-chlorophenyl)methyl]-4-{2-[(4-cyanophenyl)methoxy]-2-(3-methoxyphenyl)ethyl}piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V002-0067 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-4-{2-[(4-cyanophenyl)methoxy]-2-(3-methoxyphenyl)ethyl}piperazine-1-carboxamide |
| Molecular Weight: | 519.04 |
| Molecular Formula: | C29 H31 Cl N4 O3 |
| Smiles: | COc1cccc(c1)C(CN1CCN(CC1)C(NCc1ccccc1[Cl])=O)OCc1ccc(C#N)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3698 |
| logD: | 4.2818 |
| logSw: | -4.5862 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.051 |
| InChI Key: | ICVSIWQWIWBGBR-NDEPHWFRSA-N |