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Home > Imidazoles > 18994-86-0
18994-86-0 | 1-(4-Methylbenzyl)imidazole
CAS No: 18994-86-0 Catalog No: AG01EUFU MDL No:
Product Description
Catalog Number:
AG01EUFU
Chemical Name:
1-(4-Methylbenzyl)imidazole
CAS Number:
18994-86-0
Molecular Formula:
C11H12N2
Molecular Weight:
172.2264
IUPAC Name:
1-[(4-methylphenyl)methyl]imidazole
InChI:
InChI=1S/C11H12N2/c1-10-2-4-11(5-3-10)8-13-7-6-12-9-13/h2-7,9H,8H2,1H3
InChI Key:
DQXGQHAFADWCKG-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)Cn1cncc1
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.1g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.231g/mol
Monoisotopic Mass:
172.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Literature
| Title | Journal |
|---|---|
| Synthesis and biochemical evaluation of a range of sulfonated derivatives of 4-hydroxybenzyl imidazole as highly potent inhibitors of rat testicular 17alpha-hydroxylase/17,20-lyase (P-450(17alpha)). | Bioorganic & medicinal chemistry letters 20090815 |
| Synthesis and biochemical evaluation of a range of potent benzyl imidazole-based compounds as potential inhibitors of the enzyme complex 17alpha-hydroxylase/17,20-lyase (P450(17alpha)). | Bioorganic & medicinal chemistry letters 20060801 |
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