{(7E)-3-(4-chlorophenyl)-7-[(4-chlorophenyl)methylidene]-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)-3-(4-chlorophenyl)-7-[(4-chlorophenyl)methylidene]-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl}(1-ethyl-4-nitro-1H-pyrazol-3-yl)methanone
{(7E)-3-(4-chlorophenyl)-7-[(4-chlorophenyl)methylidene]-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl}(1-ethyl-4-nitro-1H-pyrazol-3-yl)methanone
Compound characteristics
| Compound ID: | Y501-7380 |
| Compound Name: | {(7E)-3-(4-chlorophenyl)-7-[(4-chlorophenyl)methylidene]-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl}(1-ethyl-4-nitro-1H-pyrazol-3-yl)methanone |
| Molecular Weight: | 524.41 |
| Molecular Formula: | C26 H23 Cl2 N5 O3 |
| Smiles: | CCn1cc(c(C(N2C(C3CCC/C(=C\c4ccc(cc4)[Cl])C3=N2)c2ccc(cc2)[Cl])=O)n1)[N+]([O-])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.3245 |
| logD: | 6.3245 |
| logSw: | -6.4464 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.678 |
| InChI Key: | UAYJPLCMXFVGAD-UHFFFAOYSA-N |