(5'E)-5'-[(4-heptyl-5-methyl-3-propyl-1H-pyrrol-2-yl)methylidene]-4'-methoxy-1H,5'H-2,2'-bipyrrole

AlkaPlorer ID: AK399759

Synonym: None

IUPAC Name: 4-heptyl-2-[(E)-[3-methoxy-5-(1H-pyrrol-2-yl)pyrrol-2-ylidene]methyl]-5-methyl-3-propyl-1H-pyrrole

Structure

SMILES: CCCCCCCC1=C(C)NC(/C=C2/N=C(C3=CC=CN3)C=C2OC)=C1CCC

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InChI: InChI=1S/C25H35N3O/c1-5-7-8-9-10-13-19-18(3)27-22(20(19)12-6-2)16-24-25(29-4)17-23(28-24)21-14-11-15-26-21/h11,14-17,26-27H,5-10,12-13H2,1-4H3/b24-16+

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InChIKey: HJLPJTJOEAIKSK-LFVJCYFKSA-N

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Properties Information

Molecule Weight: 393.5750000000002

TPSA: 53.17

MolLogP: 6.490720000000006

Number of H-Donors: 2

Number of H-Acceptors: 2

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information