2-[2-(4-bromothiophen-2-yl)ethenyl]-3-(4-methylphenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-[2-(4-bromothiophen-2-yl)ethenyl]-3-(4-methylphenyl)quinazolin-4(3H)-one
2-[2-(4-bromothiophen-2-yl)ethenyl]-3-(4-methylphenyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K505-0173 |
| Compound Name: | 2-[2-(4-bromothiophen-2-yl)ethenyl]-3-(4-methylphenyl)quinazolin-4(3H)-one |
| Molecular Weight: | 423.33 |
| Molecular Formula: | C21 H15 Br N2 O S |
| Smiles: | Cc1ccc(cc1)N1C(/C=C/c2cc(cs2)[Br])=Nc2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 4.8919 |
| logD: | 4.8913 |
| logSw: | -4.7171 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.6125 |
| InChI Key: | LQGYBIRSDPHNPH-UHFFFAOYSA-N |