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Home > Imidazoles > 89781-63-5
89781-63-5 | 1H-Imidazole,1-(3,4-dihydro-2-naphthalenyl)-
CAS No: 89781-63-5 Catalog No: AG004096 MDL No:
Product Description
Catalog Number:
AG004096
Chemical Name:
1H-Imidazole,1-(3,4-dihydro-2-naphthalenyl)-
CAS Number:
89781-63-5
Molecular Formula:
C13H12N2
Molecular Weight:
196.2478
IUPAC Name:
1-(3,4-dihydronaphthalen-2-yl)imidazole
InChI:
InChI=1S/C13H12N2/c1-2-4-12-9-13(6-5-11(12)3-1)15-8-7-14-10-15/h1-4,7-10H,5-6H2
InChI Key:
DHUCLDOIXQGVDQ-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)C=C(CC2)n1cncc1
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.1g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.253g/mol
Monoisotopic Mass:
196.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Literature
| Title | Journal |
|---|---|
| Synthesis and evaluation of heteroaryl-substituted dihydronaphthalenes and indenes: potent and selective inhibitors of aldosterone synthase (CYP11B2) for the treatment of congestive heart failure and myocardial fibrosis. | Journal of medicinal chemistry 20060406 |
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