2-[2-(1H-indol-3-yl)ethenyl]-6-iodo-3-(4-methoxyphenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-[2-(1H-indol-3-yl)ethenyl]-6-iodo-3-(4-methoxyphenyl)quinazolin-4(3H)-one
2-[2-(1H-indol-3-yl)ethenyl]-6-iodo-3-(4-methoxyphenyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | 4817-1000 |
| Compound Name: | 2-[2-(1H-indol-3-yl)ethenyl]-6-iodo-3-(4-methoxyphenyl)quinazolin-4(3H)-one |
| Molecular Weight: | 519.34 |
| Molecular Formula: | C25 H18 I N3 O2 |
| Smiles: | COc1ccc(cc1)N1C(/C=C/c2c[nH]c3ccccc23)=Nc2ccc(cc2C1=O)I |
| Stereo: | ACHIRAL |
| logP: | 5.9547 |
| logD: | 5.9546 |
| logSw: | -5.8234 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.009 |
| InChI Key: | BBWMCCUKISJJKX-UHFFFAOYSA-N |