4-({1-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}methyl)-N-(3-methoxypropyl)benzamide
Chemical Structure Depiction of
4-({1-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}methyl)-N-(3-methoxypropyl)benzamide
4-({1-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}methyl)-N-(3-methoxypropyl)benzamide
Compound characteristics
| Compound ID: | C260-1614 |
| Compound Name: | 4-({1-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}methyl)-N-(3-methoxypropyl)benzamide |
| Molecular Weight: | 597.44 |
| Molecular Formula: | C28 H26 Br F N4 O5 |
| Smiles: | COCCCNC(c1ccc(CN2C(c3ccccc3N(CC(Nc3ccc(cc3F)[Br])=O)C2=O)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5898 |
| logD: | 3.5823 |
| logSw: | -3.9199 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.587 |
| InChI Key: | SKXKCKSMYJGBSW-UHFFFAOYSA-N |