N-[2-(4-methylphenyl)-4-oxoquinazolin-3(4H)-yl]-4-nitrobenzamide
Chemical Structure Depiction of
N-[2-(4-methylphenyl)-4-oxoquinazolin-3(4H)-yl]-4-nitrobenzamide
N-[2-(4-methylphenyl)-4-oxoquinazolin-3(4H)-yl]-4-nitrobenzamide
Compound characteristics
| Compound ID: | 3009-4114 |
| Compound Name: | N-[2-(4-methylphenyl)-4-oxoquinazolin-3(4H)-yl]-4-nitrobenzamide |
| Molecular Weight: | 400.39 |
| Molecular Formula: | C22 H16 N4 O4 |
| Smiles: | Cc1ccc(cc1)C1=Nc2ccccc2C(N1NC(c1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9509 |
| logD: | 2.945 |
| logSw: | -3.7151 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.132 |
| InChI Key: | NBHVEZSBASGMSA-UHFFFAOYSA-N |