N-{amino[(4-methylquinazolin-2-yl)amino]methylidene}-4-nitrobenzamide
Chemical Structure Depiction of
N-{amino[(4-methylquinazolin-2-yl)amino]methylidene}-4-nitrobenzamide
N-{amino[(4-methylquinazolin-2-yl)amino]methylidene}-4-nitrobenzamide
Compound characteristics
| Compound ID: | 3389-0438 |
| Compound Name: | N-{amino[(4-methylquinazolin-2-yl)amino]methylidene}-4-nitrobenzamide |
| Molecular Weight: | 350.33 |
| Molecular Formula: | C17 H14 N6 O3 |
| Smiles: | Cc1c2ccccc2nc(NC(/N)=N/C(c2ccc(cc2)[N+]([O-])=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.6802 |
| logD: | 0.4903 |
| logSw: | -3.2592 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 105.746 |
| InChI Key: | QSLFMJWEUZCEJC-UHFFFAOYSA-N |