4-{4-[(3-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}-N-[3-(methylsulfanyl)phenyl]piperidine-1-carboxamide
Chemical Structure Depiction of
4-{4-[(3-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}-N-[3-(methylsulfanyl)phenyl]piperidine-1-carboxamide
4-{4-[(3-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}-N-[3-(methylsulfanyl)phenyl]piperidine-1-carboxamide
Compound characteristics
| Compound ID: | G909-0294 |
| Compound Name: | 4-{4-[(3-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}-N-[3-(methylsulfanyl)phenyl]piperidine-1-carboxamide |
| Molecular Weight: | 470.57 |
| Molecular Formula: | C24 H27 F N4 O3 S |
| Smiles: | CSc1cccc(c1)NC(N1CCC(CC1)N1CCN(Cc2cccc(c2)F)C(C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1222 |
| logD: | 3.1222 |
| logSw: | -3.3732 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.948 |
| InChI Key: | QYOXGEFDDGVIJI-UHFFFAOYSA-N |