1-{6-bromo-2-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-yl}-2-(4-methylphenyl)ethan-1-amine
AlkaPlorer ID: AK156164
Synonym: None
IUPAC Name: (1S)-1-[(1S)-6-bromo-2-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl]-2-(4-methylphenyl)ethanamine
Structure
SMILES: CC1=CC=C(C[C@H](N)[C@H]2C3=C(CCN2C)C2=CC(Br)=CC=C2N3)C=C1
InChI: InChI=1S/C21H24BrN3/c1-13-3-5-14(6-4-13)11-18(23)21-20-16(9-10-25(21)2)17-12-15(22)7-8-19(17)24-20/h3-8,12,18,21,24H,9-11,23H2,1-2H3/t18-,21-/m0/s1
InChIKey: FHPDHCCEDGUNMX-RXVVDRJESA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Vepris stolzii | Vepris | Rutaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Ascochyta fabae | Ascochyta | Didymellaceae | Pleosporales | Dothideomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 398.348
TPSA？: 45.05
MolLogP？: 4.337820000000003
Number of H-Donors: 2
Number of H-Acceptors: 2
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|