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 |