4-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{3-methoxy-4-[(propan-2-yl)oxy]phenyl}-1-(4-methylcyclohexyl)piperazine-2,5-dione
Chemical Structure Depiction of
4-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{3-methoxy-4-[(propan-2-yl)oxy]phenyl}-1-(4-methylcyclohexyl)piperazine-2,5-dione
4-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{3-methoxy-4-[(propan-2-yl)oxy]phenyl}-1-(4-methylcyclohexyl)piperazine-2,5-dione
Compound characteristics
Compound ID: | K784-5880 |
Compound Name: | 4-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{3-methoxy-4-[(propan-2-yl)oxy]phenyl}-1-(4-methylcyclohexyl)piperazine-2,5-dione |
Molecular Weight: | 508.62 |
Molecular Formula: | C29 H36 N2 O6 |
Smiles: | CC1CCC(CC1)N1CC(N(Cc2ccc3c(c2)OCO3)C(C1=O)c1ccc(c(c1)OC)OC(C)C)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.8286 |
logD: | 4.8286 |
logSw: | -4.6321 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 63.583 |
InChI Key: | BGRLUCQLGVENRY-CWYPTGNGSA-N |