6-bromo-N-[2-(2-fluorophenyl)-4-oxoquinazolin-3(4H)-yl]-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-bromo-N-[2-(2-fluorophenyl)-4-oxoquinazolin-3(4H)-yl]-2-oxo-2H-1-benzopyran-3-carboxamide
6-bromo-N-[2-(2-fluorophenyl)-4-oxoquinazolin-3(4H)-yl]-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 3401-5392 |
| Compound Name: | 6-bromo-N-[2-(2-fluorophenyl)-4-oxoquinazolin-3(4H)-yl]-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 506.29 |
| Molecular Formula: | C24 H13 Br F N3 O4 |
| Smiles: | C1=C(C(NN2C(c3ccccc3F)=Nc3ccccc3C2=O)=O)C(=O)Oc2ccc(cc12)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.049 |
| logD: | 2.6566 |
| logSw: | -3.7759 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.673 |
| InChI Key: | CCHLCIFFLPMXDD-UHFFFAOYSA-N |