3-(3,5-Dibromo-4-methoxyphenyl)-2-methoxy-N-methylpropylamine; (ξ)-form 

AlkaPlorer ID: AK295454

Synonym: None

IUPAC Name: 3-(3,5-dibromo-4-methoxyphenyl)-2-methoxy-N-methylpropan-1-amine

Structure

SMILES: CNCC(CC1=CC(Br)=C(OC)C(Br)=C1)OC

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InChI: InChI=1S/C12H17Br2NO2/c1-15-7-9(16-2)4-8-5-10(13)12(17-3)11(14)6-8/h5-6,9,15H,4,7H2,1-3H3

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InChIKey: SEBDGFAFHGCJNV-UHFFFAOYSA-N

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Reference

PubChem CID: 91010750

COCONUT: CNP0112693.1

Properties Information

Molecule Weight: 367.081

TPSA: 30.49

MolLogP: 2.997100000000001

Number of H-Donors: 1

Number of H-Acceptors: 3

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information