N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-bromo-4-hydroxy-2-oxo-3-phenyl-1,2,3,4-tetrahydroquinazoline-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-bromo-4-hydroxy-2-oxo-3-phenyl-1,2,3,4-tetrahydroquinazoline-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-bromo-4-hydroxy-2-oxo-3-phenyl-1,2,3,4-tetrahydroquinazoline-4-carboxamide
Compound characteristics
| Compound ID: | C109-0672 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-bromo-4-hydroxy-2-oxo-3-phenyl-1,2,3,4-tetrahydroquinazoline-4-carboxamide |
| Molecular Weight: | 496.32 |
| Molecular Formula: | C23 H18 Br N3 O5 |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(C1(c2cc(ccc2NC(N1c1ccccc1)=O)[Br])O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9873 |
| logD: | 3.9872 |
| logSw: | -4.1788 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.221 |
| InChI Key: | ZAFYJSITQMLLTO-HSZRJFAPSA-N |