CHEMBL583543

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 4
Total Number of Articles : 5
PubChem 7433743
Molecular Formula

C19H16BrNO2

SMILES

C1C=C[C@@H]2[C@H]1[C@@H](NC3=CC=CC=C23)C4=CC5=C(C=C4Br)OCO5

InChI

InChI=1S/C19H16BrNO2/c20-15-9-18-17(22-10-23-18)8-14(15)19-13-6-3-5-11(13)12-4-1-2-7-16(12)21-19/h1-5,7-9,11,13,19,21H,6,10H2/t11-,13-,19+/m0/s1

synonyms
  • 1161002-05-6
  • G15
  • (3aS,4R,9bR)-4-(6-bromo-1,3-benzodioxol-5-yl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
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Properties
Property Value
MW 370.2 g/mol
HBD 1
HBA 3
Rotatable Bond Count 1
Exact Mass 369.03644 g/mol
Monoisotopic Mass 369.03644 g/mol
Heavy Atom Count 23
Isotope Atom Count 0
Atom Stereo Count 3
Covalent Unit Count 1
Complexity 484
xlogp 4.9
Topological Polar Surface Area 30.5