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Home > Quinoline > 134794-73-3
134794-73-3 | Benz[f]isoquinoline, 3-butyl-1,2,3,4,5,6-hexahydro-
CAS No: 134794-73-3 Catalog No: AG007LRF MDL No:
Product Description
Catalog Number:
AG007LRF
Chemical Name:
Benz[f]isoquinoline, 3-butyl-1,2,3,4,5,6-hexahydro-
CAS Number:
134794-73-3
Molecular Formula:
C17H23N
Molecular Weight:
241.3712
IUPAC Name:
3-butyl-2,4,5,6-tetrahydro-1H-benzo[f]isoquinoline
InChI:
InChI=1S/C17H23N/c1-2-3-11-18-12-10-17-15(13-18)9-8-14-6-4-5-7-16(14)17/h4-7H,2-3,8-13H2,1H3
InChI Key:
VXQVYBORCSUFDN-UHFFFAOYSA-N
SMILES:
CCCCN1CCC2=C(C1)CCc1c2cccc1
Properties
Complexity:
318
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.183g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.378g/mol
Monoisotopic Mass:
241.183g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Literature
| Title | Journal |
|---|---|
| Design, synthesis, and evaluation of hexahydrobenz[f]isoquinolines as a novel class of dopamine 3 receptor ligands. | Bioorganic & medicinal chemistry letters 20041206 |
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