N-(3-chloro-2-methylphenyl)-2-{4-[(2-methylphenyl)methyl]-2,3-dioxopiperazin-1-yl}acetamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-2-{4-[(2-methylphenyl)methyl]-2,3-dioxopiperazin-1-yl}acetamide
N-(3-chloro-2-methylphenyl)-2-{4-[(2-methylphenyl)methyl]-2,3-dioxopiperazin-1-yl}acetamide
Compound characteristics
| Compound ID: | F512-1503 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-2-{4-[(2-methylphenyl)methyl]-2,3-dioxopiperazin-1-yl}acetamide |
| Molecular Weight: | 399.88 |
| Molecular Formula: | C21 H22 Cl N3 O3 |
| Smiles: | Cc1ccccc1CN1CCN(CC(Nc2cccc(c2C)[Cl])=O)C(C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5526 |
| logD: | 3.5524 |
| logSw: | -3.6285 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.735 |
| InChI Key: | FKKBDAQRYQXXJC-UHFFFAOYSA-N |