N-[(2-chlorophenyl)methyl]-2-{4-[(4-methylphenyl)methyl]-2,3-dioxopiperazin-1-yl}acetamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-2-{4-[(4-methylphenyl)methyl]-2,3-dioxopiperazin-1-yl}acetamide
N-[(2-chlorophenyl)methyl]-2-{4-[(4-methylphenyl)methyl]-2,3-dioxopiperazin-1-yl}acetamide
Compound characteristics
| Compound ID: | F512-1049 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-2-{4-[(4-methylphenyl)methyl]-2,3-dioxopiperazin-1-yl}acetamide |
| Molecular Weight: | 399.88 |
| Molecular Formula: | C21 H22 Cl N3 O3 |
| Smiles: | Cc1ccc(CN2CCN(CC(NCc3ccccc3[Cl])=O)C(C2=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.6239 |
| logD: | 2.6239 |
| logSw: | -3.2991 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.755 |
| InChI Key: | AQNRLHWVIYTPRU-UHFFFAOYSA-N |