200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 1224101-97-6
1224101-97-6 | 3-methyl-1-{4H,5H,6H,7H-thieno[3,2-c]pyridine-5-carbonyl}-1H-imidazol-3-ium iodide
CAS No: 1224101-97-6 Catalog No: AG019PQK MDL No:MFCD11099754
Product Description
Catalog Number:
AG019PQK
Chemical Name:
3-methyl-1-{4H,5H,6H,7H-thieno[3,2-c]pyridine-5-carbonyl}-1H-imidazol-3-ium iodide
CAS Number:
1224101-97-6
Molecular Formula:
C12H14IN3OS
Molecular Weight:
375.2285
MDL Number:
MFCD11099754
IUPAC Name:
6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(3-methylimidazol-3-ium-1-yl)methanone;iodide
InChI:
InChI=1S/C12H14N3OS.HI/c1-13-5-6-15(9-13)12(16)14-4-2-11-10(8-14)3-7-17-11;/h3,5-7,9H,2,4,8H2,1H3;1H/q+1;/p-1
InChI Key:
NAAHVTTXTOHDSU-UHFFFAOYSA-M
SMILES:
C[n+]1ccn(c1)C(=O)N1CCc2c(C1)ccs2.[I-]
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.99g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
375.228g/mol
Monoisotopic Mass:
374.99g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
57.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.