5-bromo-N-(4-{1-[2-(1,3-dimethyl-4-nitro-1H-pyrazole-5-carbonyl)hydrazinylidene]ethyl}phenyl)furan-2-carboxamide
Chemical Structure Depiction of
5-bromo-N-(4-{1-[2-(1,3-dimethyl-4-nitro-1H-pyrazole-5-carbonyl)hydrazinylidene]ethyl}phenyl)furan-2-carboxamide
5-bromo-N-(4-{1-[2-(1,3-dimethyl-4-nitro-1H-pyrazole-5-carbonyl)hydrazinylidene]ethyl}phenyl)furan-2-carboxamide
Compound characteristics
| Compound ID: | Y509-0616 |
| Compound Name: | 5-bromo-N-(4-{1-[2-(1,3-dimethyl-4-nitro-1H-pyrazole-5-carbonyl)hydrazinylidene]ethyl}phenyl)furan-2-carboxamide |
| Molecular Weight: | 489.28 |
| Molecular Formula: | C19 H17 Br N6 O5 |
| Smiles: | C\C(c1ccc(cc1)NC(c1ccc(o1)[Br])=O)=N/NC(c1c(c(C)nn1C)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5372 |
| logD: | 1.6145 |
| logSw: | -3.0082 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 113.507 |
| InChI Key: | GWLCIJODMXYMAG-UHFFFAOYSA-N |