N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[2,4-dioxo-1-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-1,4-dihydroquinazolin-3(2H)-yl]propanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[2,4-dioxo-1-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-1,4-dihydroquinazolin-3(2H)-yl]propanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[2,4-dioxo-1-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-1,4-dihydroquinazolin-3(2H)-yl]propanamide
Compound characteristics
| Compound ID: | C260-1756 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[2,4-dioxo-1-{2-oxo-2-[3-(trifluoromethyl)anilino]ethyl}-1,4-dihydroquinazolin-3(2H)-yl]propanamide |
| Molecular Weight: | 568.51 |
| Molecular Formula: | C28 H23 F3 N4 O6 |
| Smiles: | C(CN1C(c2ccccc2N(CC(Nc2cccc(c2)C(F)(F)F)=O)C1=O)=O)C(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.874 |
| logD: | 3.8736 |
| logSw: | -4.154 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.981 |
| InChI Key: | GPKPUHLFJGGDHR-UHFFFAOYSA-N |