ethyl (2Z)-3-[7-methoxy-3-(4-nitrophenyl)-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl]but-2-enoate
Chemical Structure Depiction of
ethyl (2Z)-3-[7-methoxy-3-(4-nitrophenyl)-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl]but-2-enoate
ethyl (2Z)-3-[7-methoxy-3-(4-nitrophenyl)-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl]but-2-enoate
Compound characteristics
| Compound ID: | 4157-0847 |
| Compound Name: | ethyl (2Z)-3-[7-methoxy-3-(4-nitrophenyl)-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl]but-2-enoate |
| Molecular Weight: | 435.48 |
| Molecular Formula: | C24 H25 N3 O5 |
| Smiles: | CCOC(/C=C(/C)N1C(C2CCc3cc(ccc3C2=N1)OC)c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5439 |
| logD: | 5.5436 |
| logSw: | -5.4949 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.965 |
| InChI Key: | LEEWAGAMSISGKO-UHFFFAOYSA-N |