N-[2-(3,4-dimethylphenyl)-4-oxoquinazolin-3(4H)-yl]-3-nitrobenzamide
Chemical Structure Depiction of
N-[2-(3,4-dimethylphenyl)-4-oxoquinazolin-3(4H)-yl]-3-nitrobenzamide
N-[2-(3,4-dimethylphenyl)-4-oxoquinazolin-3(4H)-yl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | 3009-4001 |
| Compound Name: | N-[2-(3,4-dimethylphenyl)-4-oxoquinazolin-3(4H)-yl]-3-nitrobenzamide |
| Molecular Weight: | 414.42 |
| Molecular Formula: | C23 H18 N4 O4 |
| Smiles: | Cc1ccc(cc1C)C1=Nc2ccccc2C(N1NC(c1cccc(c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5078 |
| logD: | 3.4975 |
| logSw: | -3.8908 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.132 |
| InChI Key: | DHOXQVKPYSEIGW-UHFFFAOYSA-N |