6-bromo-2-{2-[(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)methylidene]hydrazinyl}-4-phenylquinazoline
Chemical Structure Depiction of
6-bromo-2-{2-[(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)methylidene]hydrazinyl}-4-phenylquinazoline
6-bromo-2-{2-[(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)methylidene]hydrazinyl}-4-phenylquinazoline
Compound characteristics
| Compound ID: | 0647-0044 |
| Compound Name: | 6-bromo-2-{2-[(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)methylidene]hydrazinyl}-4-phenylquinazoline |
| Molecular Weight: | 506.31 |
| Molecular Formula: | C23 H16 Br N5 O4 |
| Smiles: | C1COc2cc(c(/C=N/Nc3nc(c4ccccc4)c4cc(ccc4n3)[Br])cc2O1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.9143 |
| logD: | 4.9141 |
| logSw: | -5.0346 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.198 |
| InChI Key: | TZJYEURSABFGRE-UHFFFAOYSA-N |