1-[3-(4-bromophenyl)-7-methoxy-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl]propan-1-one
Chemical Structure Depiction of
1-[3-(4-bromophenyl)-7-methoxy-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl]propan-1-one
1-[3-(4-bromophenyl)-7-methoxy-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl]propan-1-one
Compound characteristics
| Compound ID: | 6395-0079 |
| Compound Name: | 1-[3-(4-bromophenyl)-7-methoxy-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl]propan-1-one |
| Molecular Weight: | 413.31 |
| Molecular Formula: | C21 H21 Br N2 O2 |
| Smiles: | CCC(N1C(C2CCc3cc(ccc3C2=N1)OC)c1ccc(cc1)[Br])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5204 |
| logD: | 5.5204 |
| logSw: | -5.4619 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.837 |
| InChI Key: | VDJMXNSHMOACDS-UHFFFAOYSA-N |