N-[6-bromo-2-{2-[(3-bromophenyl)methoxy]phenyl}-4-oxo-1,4-dihydroquinazolin-3(2H)-yl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[6-bromo-2-{2-[(3-bromophenyl)methoxy]phenyl}-4-oxo-1,4-dihydroquinazolin-3(2H)-yl]-2H-1,3-benzodioxole-5-carboxamide
N-[6-bromo-2-{2-[(3-bromophenyl)methoxy]phenyl}-4-oxo-1,4-dihydroquinazolin-3(2H)-yl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | Y500-5532 |
| Compound Name: | N-[6-bromo-2-{2-[(3-bromophenyl)methoxy]phenyl}-4-oxo-1,4-dihydroquinazolin-3(2H)-yl]-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 651.31 |
| Molecular Formula: | C29 H21 Br2 N3 O5 |
| Smiles: | C(c1cccc(c1)[Br])Oc1ccccc1C1Nc2ccc(cc2C(N1NC(c1ccc2c(c1)OCO2)=O)=O)[Br] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7665 |
| logD: | 5.723 |
| logSw: | -6.2077 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.174 |
| InChI Key: | WCEQAZACPYXRMH-HHHXNRCGSA-N |