3-[(3-bromo-4-methoxybenzoyl)oxy]-2-(4-tert-butylphenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
3-[(3-bromo-4-methoxybenzoyl)oxy]-2-(4-tert-butylphenyl)quinazolin-4(3H)-one
3-[(3-bromo-4-methoxybenzoyl)oxy]-2-(4-tert-butylphenyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | 3129-4990 |
| Compound Name: | 3-[(3-bromo-4-methoxybenzoyl)oxy]-2-(4-tert-butylphenyl)quinazolin-4(3H)-one |
| Molecular Weight: | 507.38 |
| Molecular Formula: | C26 H23 Br N2 O4 |
| Smiles: | CC(C)(C)c1ccc(cc1)C1=Nc2ccccc2C(N1OC(c1ccc(c(c1)[Br])OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6757 |
| logD: | 5.6722 |
| logSw: | -5.5219 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.881 |
| InChI Key: | IEJTVOHIMCGPAN-UHFFFAOYSA-N |