ethyl 2-[(4-{4-[(4-methylphenyl)methyl]-2,3-dioxopiperazin-1-yl}piperidine-1-carbonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 2-[(4-{4-[(4-methylphenyl)methyl]-2,3-dioxopiperazin-1-yl}piperidine-1-carbonyl)amino]benzoate
ethyl 2-[(4-{4-[(4-methylphenyl)methyl]-2,3-dioxopiperazin-1-yl}piperidine-1-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | G909-0101 |
| Compound Name: | ethyl 2-[(4-{4-[(4-methylphenyl)methyl]-2,3-dioxopiperazin-1-yl}piperidine-1-carbonyl)amino]benzoate |
| Molecular Weight: | 492.57 |
| Molecular Formula: | C27 H32 N4 O5 |
| Smiles: | CCOC(c1ccccc1NC(N1CCC(CC1)N1CCN(Cc2ccc(C)cc2)C(C1=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6268 |
| logD: | 3.626 |
| logSw: | -3.6346 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.004 |
| InChI Key: | VRVDGRKAHWJJJR-UHFFFAOYSA-N |