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Home > Imidazoles > 138944-33-9
138944-33-9 | 1H-Imidazole-5-carboxamide, 2-methoxy-4-methyl-N-phenyl-
CAS No: 138944-33-9 Catalog No: AG0019VX MDL No:
Product Description
Catalog Number:
AG0019VX
Chemical Name:
1H-Imidazole-5-carboxamide, 2-methoxy-4-methyl-N-phenyl-
CAS Number:
138944-33-9
Molecular Formula:
C12H13N3O2
Molecular Weight:
231.2505
IUPAC Name:
2-methoxy-5-methyl-N-phenyl-1H-imidazole-4-carboxamide
InChI:
InChI=1S/C12H13N3O2/c1-8-10(15-12(13-8)17-2)11(16)14-9-6-4-3-5-7-9/h3-7H,1-2H3,(H,13,15)(H,14,16)
InChI Key:
NEBDNCAHALUEFK-UHFFFAOYSA-N
SMILES:
COc1nc(c([nH]1)C(=O)Nc1ccccc1)C
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.101g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
231.255g/mol
Monoisotopic Mass:
231.101g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
67A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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