3-{1-[2-(4-fluoroanilino)-2-oxoethyl]-6,7-dimethoxy-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[(oxolan-2-yl)methyl]propanamide
Chemical Structure Depiction of
3-{1-[2-(4-fluoroanilino)-2-oxoethyl]-6,7-dimethoxy-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[(oxolan-2-yl)methyl]propanamide
3-{1-[2-(4-fluoroanilino)-2-oxoethyl]-6,7-dimethoxy-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[(oxolan-2-yl)methyl]propanamide
Compound characteristics
| Compound ID: | C191-0444 |
| Compound Name: | 3-{1-[2-(4-fluoroanilino)-2-oxoethyl]-6,7-dimethoxy-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[(oxolan-2-yl)methyl]propanamide |
| Molecular Weight: | 528.54 |
| Molecular Formula: | C26 H29 F N4 O7 |
| Smiles: | COc1cc2C(N(CCC(NCC3CCCO3)=O)C(N(CC(Nc3ccc(cc3)F)=O)c2cc1OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7804 |
| logD: | 1.7803 |
| logSw: | -2.6657 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.781 |
| InChI Key: | HXMSPURIZWWCIU-GOSISDBHSA-N |