methyl 2-[(4-{2-[(4-cyanophenyl)methoxy]-2-(3-methoxyphenyl)ethyl}piperazine-1-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 2-[(4-{2-[(4-cyanophenyl)methoxy]-2-(3-methoxyphenyl)ethyl}piperazine-1-carbonyl)amino]benzoate
methyl 2-[(4-{2-[(4-cyanophenyl)methoxy]-2-(3-methoxyphenyl)ethyl}piperazine-1-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | V002-0963 |
| Compound Name: | methyl 2-[(4-{2-[(4-cyanophenyl)methoxy]-2-(3-methoxyphenyl)ethyl}piperazine-1-carbonyl)amino]benzoate |
| Molecular Weight: | 528.61 |
| Molecular Formula: | C30 H32 N4 O5 |
| Salt: | not_available |
| Smiles: | COC(c1ccccc1NC(N1CCN(CC1)CC(c1cccc(c1)OC)OCc1ccc(C#N)cc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0809 |
| logD: | 4.043 |
| logSw: | -4.2301 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.204 |
| InChI Key: | ABGNBSQEXMZNNE-NDEPHWFRSA-N |