1-[8-methoxy-3-(4-methoxyphenyl)-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl]ethan-1-one
Chemical Structure Depiction of
1-[8-methoxy-3-(4-methoxyphenyl)-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl]ethan-1-one
1-[8-methoxy-3-(4-methoxyphenyl)-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl]ethan-1-one
Compound characteristics
| Compound ID: | 8007-5187 |
| Compound Name: | 1-[8-methoxy-3-(4-methoxyphenyl)-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl]ethan-1-one |
| Molecular Weight: | 350.42 |
| Molecular Formula: | C21 H22 N2 O3 |
| Smiles: | CC(N1C(C2CCc3ccc(cc3C2=N1)OC)c1ccc(cc1)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2033 |
| logD: | 4.2033 |
| logSw: | -4.5673 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.376 |
| InChI Key: | QXGBVUBUQAGSCW-UHFFFAOYSA-N |