(3E)-4-(8-methoxy-3-phenyl-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl)pent-3-en-2-one
Chemical Structure Depiction of
(3E)-4-(8-methoxy-3-phenyl-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl)pent-3-en-2-one
(3E)-4-(8-methoxy-3-phenyl-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl)pent-3-en-2-one
Compound characteristics
Compound ID: | 6395-0113 |
Compound Name: | (3E)-4-(8-methoxy-3-phenyl-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl)pent-3-en-2-one |
Molecular Weight: | 360.45 |
Molecular Formula: | C23 H24 N2 O2 |
Smiles: | C/C(=C\C(C)=O)N1C(C2CCc3ccc(cc3C2=N1)OC)c1ccccc1 |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 5.1924 |
logD: | 5.1917 |
logSw: | -5.1638 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 32.76 |
InChI Key: | TUABOXZEXOEAHC-UHFFFAOYSA-N |