2-[2-(2H-1,3-benzodioxol-5-yl)ethenyl]-3-(3-chloro-4-fluorophenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-[2-(2H-1,3-benzodioxol-5-yl)ethenyl]-3-(3-chloro-4-fluorophenyl)quinazolin-4(3H)-one
2-[2-(2H-1,3-benzodioxol-5-yl)ethenyl]-3-(3-chloro-4-fluorophenyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K505-0262 |
| Compound Name: | 2-[2-(2H-1,3-benzodioxol-5-yl)ethenyl]-3-(3-chloro-4-fluorophenyl)quinazolin-4(3H)-one |
| Molecular Weight: | 420.83 |
| Molecular Formula: | C23 H14 Cl F N2 O3 |
| Smiles: | C1Oc2ccc(/C=C/C3=Nc4ccccc4C(N3c3ccc(c(c3)[Cl])F)=O)cc2O1 |
| Stereo: | ACHIRAL |
| logP: | 4.6868 |
| logD: | 4.6866 |
| logSw: | -5.021 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.71 |
| InChI Key: | VOSLNEQPLBRUNF-UHFFFAOYSA-N |