(3E)-4-[3-(3-fluorophenyl)-8-methoxy-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl]pent-3-en-2-one
Chemical Structure Depiction of
(3E)-4-[3-(3-fluorophenyl)-8-methoxy-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl]pent-3-en-2-one
(3E)-4-[3-(3-fluorophenyl)-8-methoxy-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl]pent-3-en-2-one
Compound characteristics
| Compound ID: | 6395-0118 |
| Compound Name: | (3E)-4-[3-(3-fluorophenyl)-8-methoxy-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl]pent-3-en-2-one |
| Molecular Weight: | 378.45 |
| Molecular Formula: | C23 H23 F N2 O2 |
| Smiles: | C/C(=C\C(C)=O)N1C(C2CCc3ccc(cc3C2=N1)OC)c1cccc(c1)F |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2368 |
| logD: | 5.2364 |
| logSw: | -5.213 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.76 |
| InChI Key: | BKGCBQQOVSYANO-UHFFFAOYSA-N |