N-[6-iodo-2-{2-[(3-methoxyphenyl)methoxy]phenyl}-4-oxo-1,4-dihydroquinazolin-3(2H)-yl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[6-iodo-2-{2-[(3-methoxyphenyl)methoxy]phenyl}-4-oxo-1,4-dihydroquinazolin-3(2H)-yl]-2H-1,3-benzodioxole-5-carboxamide
N-[6-iodo-2-{2-[(3-methoxyphenyl)methoxy]phenyl}-4-oxo-1,4-dihydroquinazolin-3(2H)-yl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | Y500-5549 |
| Compound Name: | N-[6-iodo-2-{2-[(3-methoxyphenyl)methoxy]phenyl}-4-oxo-1,4-dihydroquinazolin-3(2H)-yl]-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 649.44 |
| Molecular Formula: | C30 H24 I N3 O6 |
| Smiles: | COc1cccc(COc2ccccc2C2Nc3ccc(cc3C(N2NC(c2ccc3c(c2)OCO3)=O)=O)I)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7961 |
| logD: | 6.4022 |
| logSw: | -5.731 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.718 |
| InChI Key: | UFAUBIZXADIMOY-MUUNZHRXSA-N |