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Home > Imidazoles > 14486-52-3
14486-52-3 | 1H-Imidazole, 1-methyl-2-(methylthio)-
CAS No: 14486-52-3 Catalog No: AG001K8M MDL No:MFCD25959069
Product Description
Catalog Number:
AG001K8M
Chemical Name:
1H-Imidazole, 1-methyl-2-(methylthio)-
CAS Number:
14486-52-3
Molecular Formula:
C5H8N2S
Molecular Weight:
128.1954
MDL Number:
MFCD25959069
IUPAC Name:
1-methyl-2-methylsulfanylimidazole
InChI:
InChI=1S/C5H8N2S/c1-7-4-3-6-5(7)8-2/h3-4H,1-2H3
InChI Key:
LKIVEIAXFZBGMO-UHFFFAOYSA-N
SMILES:
CSc1nccn1C
Properties
Complexity:
76.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.041g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
128.193g/mol
Monoisotopic Mass:
128.041g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
Literature
| Title | Journal |
|---|---|
| Synthesis and calcium channel antagonist activity of nifedipine analogues with methylthioimidazole substituent. | Farmaco (Societa chimica italiana : 1989) 20020301 |
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