| Phytochemical Name : Fagaramide |
| PCNDIDF0001 |
| Pubchem CID : 5281772 |
| Molecular formula: C14H17NO3 |
| Canonical SMILES : CC(C)CNC(=O)C=CC1=CC2=C(C=C1)OCO2 |
Synonymes : Fagaramide|trans-fagaramide|495-86-3|60045-88-7|FOGARAMIDE|Piperonyl-4-aacrylylisobutylamide|2-Propenamide, 3-(1,3-benzodioxol-5-yl)-N-(2-methylpropyl)-|N-Isobutyl-3,4-methylenedioxycinnamamide|AI3-30755|CHEBI:4966|NSC-94257|3-(1,3-Benzodioxo-5-yl)-N-(2-methylpropyl)-2-propenamide|Cinnamamide, N-isobutyl-3,4-methylenedioxy-|Cinnamamide, N-isobutyl-3,4- (methylenedioxy)-|Cinnamamide, N-isobutyl-3,4-(methylenedioxy)-, (E)-|(E)-3-(1,3-benzodioxol-5-yl)-N-isobutyl-prop-2-enamide|2-Propenamide, 3-(1,3-benzodioxol-5-yl)-N-(2-methylpropyl)-, (2E)-|C2UHL92KKP|AC1NQZ1T|Cinnamamide, N-isobutyl-3,4-(methylenedioxy)-, stereoisomer|Fagaramid|NSC 94257|CHEMBL252709|SCHEMBL2987846|SCHEMBL17073972|Cinnamamide,4-(methylenedioxy)-|3-(1,3-benzodioxol-5-yl)-N-(2-methylpropyl)prop-2-enamide|DTXSID001318385|HMS1750A04|(E)-3-(1,3-benzodioxol-5-yl)-N-(2-methylpropyl)prop-2-enamide|NSC94257|AKOS001133721|N-Isobutyl-3,4-methylenedioxy cinnamide|Cinnamamide,4-(methylenedioxy)-, stereoisomer|T5404670|Q27106593|Z32386287|(2E)-3-(1,3-benzodioxol-5-yl)-N-isobutyl-2-propenamide|3-(1,3-Benzodioxole-5-yl)-N-(2-methylpropyl)propeneamide|2-Propenamide,3-benzodioxol-5-yl)-N-(2-methylpropyl)-, (E)- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.920 |
| Log Po/w (XLOGP3) : 3.670 |
| Log Po/w (WLOGP) : 2.090 |
| Log Po/w (MLOGP) : 1.720 |
| Log Po/w (SILICOS-IT) : 2.850 |
| Consensus Log Po/w : 2.650 |