8-bromo-3-{2-[(4-nitrophenyl)methylidene]hydrazinyl}-5H-[1,2,4]triazino[5,6-b]indole
Chemical Structure Depiction of
8-bromo-3-{2-[(4-nitrophenyl)methylidene]hydrazinyl}-5H-[1,2,4]triazino[5,6-b]indole
8-bromo-3-{2-[(4-nitrophenyl)methylidene]hydrazinyl}-5H-[1,2,4]triazino[5,6-b]indole
Compound characteristics
| Compound ID: | 0651-0049 |
| Compound Name: | 8-bromo-3-{2-[(4-nitrophenyl)methylidene]hydrazinyl}-5H-[1,2,4]triazino[5,6-b]indole |
| Molecular Weight: | 412.2 |
| Molecular Formula: | C16 H10 Br N7 O2 |
| Smiles: | C(\c1ccc(cc1)[N+]([O-])=O)=N/Nc1nc2c(c3cc(ccc3[nH]2)[Br])nn1 |
| Stereo: | ACHIRAL |
| logP: | 3.6173 |
| logD: | 3.6171 |
| logSw: | -4.045 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.737 |
| InChI Key: | OXQVHHVMVKEYOM-UHFFFAOYSA-N |