2-[2-(4-bromothiophen-2-yl)ethenyl]-3-(3,4-dimethylphenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-[2-(4-bromothiophen-2-yl)ethenyl]-3-(3,4-dimethylphenyl)quinazolin-4(3H)-one
2-[2-(4-bromothiophen-2-yl)ethenyl]-3-(3,4-dimethylphenyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K505-0326 |
| Compound Name: | 2-[2-(4-bromothiophen-2-yl)ethenyl]-3-(3,4-dimethylphenyl)quinazolin-4(3H)-one |
| Molecular Weight: | 437.36 |
| Molecular Formula: | C22 H17 Br N2 O S |
| Smiles: | Cc1ccc(cc1C)N1C(/C=C/c2cc(cs2)[Br])=Nc2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 5.6011 |
| logD: | 5.5983 |
| logSw: | -5.4946 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.6125 |
| InChI Key: | MTKWHRWNZIFZPX-UHFFFAOYSA-N |