6-iodo-3-(2-methylphenyl)-2-[2-(5-nitrofuran-2-yl)ethenyl]quinazolin-4(3H)-one
Chemical Structure Depiction of
6-iodo-3-(2-methylphenyl)-2-[2-(5-nitrofuran-2-yl)ethenyl]quinazolin-4(3H)-one
6-iodo-3-(2-methylphenyl)-2-[2-(5-nitrofuran-2-yl)ethenyl]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | 4227-2677 |
| Compound Name: | 6-iodo-3-(2-methylphenyl)-2-[2-(5-nitrofuran-2-yl)ethenyl]quinazolin-4(3H)-one |
| Molecular Weight: | 499.26 |
| Molecular Formula: | C21 H14 I N3 O4 |
| Smiles: | Cc1ccccc1N1C(/C=C/c2ccc([N+]([O-])=O)o2)=Nc2ccc(cc2C1=O)I |
| Stereo: | ACHIRAL |
| logP: | 5.3282 |
| logD: | 5.328 |
| logSw: | -5.3943 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.124 |
| InChI Key: | AKEBAIHBHUXGLU-UHFFFAOYSA-N |