3-{4-[(4-methylphenyl)methyl]-2,3-dioxo-3,4-dihydroquinoxalin-1(2H)-yl}-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]propanamide
Chemical Structure Depiction of
3-{4-[(4-methylphenyl)methyl]-2,3-dioxo-3,4-dihydroquinoxalin-1(2H)-yl}-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]propanamide
3-{4-[(4-methylphenyl)methyl]-2,3-dioxo-3,4-dihydroquinoxalin-1(2H)-yl}-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]propanamide
Compound characteristics
| Compound ID: | L058-0876 |
| Compound Name: | 3-{4-[(4-methylphenyl)methyl]-2,3-dioxo-3,4-dihydroquinoxalin-1(2H)-yl}-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]propanamide |
| Molecular Weight: | 459.55 |
| Molecular Formula: | C26 H29 N5 O3 |
| Smiles: | Cc1ccc(CN2C(C(N(CCC(NCc3c(C)nn(C)c3C)=O)c3ccccc23)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.5447 |
| logD: | 2.5447 |
| logSw: | -2.67 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.813 |
| InChI Key: | HDPMBASPNKUGNW-UHFFFAOYSA-N |