N-(5-chloro-2-methylphenyl)-2-{4-[(3-methylphenyl)methyl]-2,3-dioxopiperazin-1-yl}acetamide
Chemical Structure Depiction of
N-(5-chloro-2-methylphenyl)-2-{4-[(3-methylphenyl)methyl]-2,3-dioxopiperazin-1-yl}acetamide
N-(5-chloro-2-methylphenyl)-2-{4-[(3-methylphenyl)methyl]-2,3-dioxopiperazin-1-yl}acetamide
Compound characteristics
| Compound ID: | F512-1607 |
| Compound Name: | N-(5-chloro-2-methylphenyl)-2-{4-[(3-methylphenyl)methyl]-2,3-dioxopiperazin-1-yl}acetamide |
| Molecular Weight: | 399.88 |
| Molecular Formula: | C21 H22 Cl N3 O3 |
| Smiles: | Cc1cccc(CN2CCN(CC(Nc3cc(ccc3C)[Cl])=O)C(C2=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.9445 |
| logD: | 2.9443 |
| logSw: | -3.3042 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.735 |
| InChI Key: | CAEYAEHJSVSRJZ-UHFFFAOYSA-N |