1-{3-[4-(dimethylamino)phenyl]-8-methoxy-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl}ethan-1-one
Chemical Structure Depiction of
1-{3-[4-(dimethylamino)phenyl]-8-methoxy-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl}ethan-1-one
1-{3-[4-(dimethylamino)phenyl]-8-methoxy-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl}ethan-1-one
Compound characteristics
| Compound ID: | 6395-0088 |
| Compound Name: | 1-{3-[4-(dimethylamino)phenyl]-8-methoxy-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl}ethan-1-one |
| Molecular Weight: | 363.46 |
| Molecular Formula: | C22 H25 N3 O2 |
| Smiles: | CC(N1C(C2CCc3ccc(cc3C2=N1)OC)c1ccc(cc1)N(C)C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.311 |
| logD: | 4.3072 |
| logSw: | -4.6077 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.637 |
| InChI Key: | DSMFEJUJISYLBI-UHFFFAOYSA-N |