ethyl (2E)-3-[7-methoxy-3-(4-methoxyphenyl)-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl]but-2-enoate
Chemical Structure Depiction of
ethyl (2E)-3-[7-methoxy-3-(4-methoxyphenyl)-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl]but-2-enoate
ethyl (2E)-3-[7-methoxy-3-(4-methoxyphenyl)-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl]but-2-enoate
Compound characteristics
| Compound ID: | 1653-0005 |
| Compound Name: | ethyl (2E)-3-[7-methoxy-3-(4-methoxyphenyl)-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl]but-2-enoate |
| Molecular Weight: | 420.51 |
| Molecular Formula: | C25 H28 N2 O4 |
| Smiles: | CCOC(\C=C(/C)N1C(C2CCc3cc(ccc3C2=N1)OC)c1ccc(cc1)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.6006 |
| logD: | 5.6003 |
| logSw: | -5.5195 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.128 |
| InChI Key: | FJTFTZVGRDPERP-UHFFFAOYSA-N |