N-(3-chloro-4-methoxyphenyl)-2-{4-[(4-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}butanamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-{4-[(4-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}butanamide
N-(3-chloro-4-methoxyphenyl)-2-{4-[(4-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}butanamide
Compound characteristics
| Compound ID: | F512-0850 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-{4-[(4-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}butanamide |
| Molecular Weight: | 447.89 |
| Molecular Formula: | C22 H23 Cl F N3 O4 |
| Smiles: | CCC(C(Nc1ccc(c(c1)[Cl])OC)=O)N1CCN(Cc2ccc(cc2)F)C(C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0944 |
| logD: | 3.0937 |
| logSw: | -3.4762 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.368 |
| InChI Key: | APQMGUGDNXUSRT-SFHVURJKSA-N |