[(7E)-7-benzylidene-3-phenyl-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl](1-ethyl-4-nitro-1H-pyrazol-3-yl)methanone
Chemical Structure Depiction of
[(7E)-7-benzylidene-3-phenyl-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl](1-ethyl-4-nitro-1H-pyrazol-3-yl)methanone
[(7E)-7-benzylidene-3-phenyl-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl](1-ethyl-4-nitro-1H-pyrazol-3-yl)methanone
Compound characteristics
| Compound ID: | Y501-7393 |
| Compound Name: | [(7E)-7-benzylidene-3-phenyl-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl](1-ethyl-4-nitro-1H-pyrazol-3-yl)methanone |
| Molecular Weight: | 455.52 |
| Molecular Formula: | C26 H25 N5 O3 |
| Smiles: | CCn1cc(c(C(N2C(C3CCC/C(=C\c4ccccc4)C3=N2)c2ccccc2)=O)n1)[N+]([O-])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1436 |
| logD: | 5.1436 |
| logSw: | -5.0324 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.678 |
| InChI Key: | WZHHHDJSUCNATG-UHFFFAOYSA-N |