3-{6-bromo-3-[2-(4-methoxyphenyl)ethyl]-4-oxo-3,4-dihydroquinazolin-2-yl}benzonitrile
Chemical Structure Depiction of
3-{6-bromo-3-[2-(4-methoxyphenyl)ethyl]-4-oxo-3,4-dihydroquinazolin-2-yl}benzonitrile
3-{6-bromo-3-[2-(4-methoxyphenyl)ethyl]-4-oxo-3,4-dihydroquinazolin-2-yl}benzonitrile
Compound characteristics
| Compound ID: | V008-6219 |
| Compound Name: | 3-{6-bromo-3-[2-(4-methoxyphenyl)ethyl]-4-oxo-3,4-dihydroquinazolin-2-yl}benzonitrile |
| Molecular Weight: | 460.33 |
| Molecular Formula: | C24 H18 Br N3 O2 |
| Smiles: | COc1ccc(CCN2C(c3cccc(C#N)c3)=Nc3ccc(cc3C2=O)[Br])cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.9299 |
| logD: | 4.9295 |
| logSw: | -4.6575 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.928 |
| InChI Key: | DZNUCLSAJGMEBQ-UHFFFAOYSA-N |