methyl 2-{[4-(4-benzyl-2,3-dioxopiperazin-1-yl)piperidine-1-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[4-(4-benzyl-2,3-dioxopiperazin-1-yl)piperidine-1-carbonyl]amino}benzoate
methyl 2-{[4-(4-benzyl-2,3-dioxopiperazin-1-yl)piperidine-1-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | G909-0011 |
| Compound Name: | methyl 2-{[4-(4-benzyl-2,3-dioxopiperazin-1-yl)piperidine-1-carbonyl]amino}benzoate |
| Molecular Weight: | 464.52 |
| Molecular Formula: | C25 H28 N4 O5 |
| Smiles: | COC(c1ccccc1NC(N1CCC(CC1)N1CCN(Cc2ccccc2)C(C1=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6598 |
| logD: | 2.6589 |
| logSw: | -3.2864 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.424 |
| InChI Key: | DWZRIAFGZZHATD-UHFFFAOYSA-N |