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Home > Imidazoles > 88934-03-6
88934-03-6 | 1H-Imidazole-4-carboxamide, N-(3-ethylphenyl)-5-methyl-
CAS No: 88934-03-6 Catalog No: AG0048UJ MDL No:
Product Description
Catalog Number:
AG0048UJ
Chemical Name:
1H-Imidazole-4-carboxamide, N-(3-ethylphenyl)-5-methyl-
CAS Number:
88934-03-6
Molecular Formula:
C13H15N3O
Molecular Weight:
229.2777
IUPAC Name:
N-(3-ethylphenyl)-5-methyl-1H-imidazole-4-carboxamide
InChI:
InChI=1S/C13H15N3O/c1-3-10-5-4-6-11(7-10)16-13(17)12-9(2)14-8-15-12/h4-8H,3H2,1-2H3,(H,14,15)(H,16,17)
InChI Key:
YQQDJMZZSPANFX-UHFFFAOYSA-N
SMILES:
CCc1cccc(c1)NC(=O)c1nc[nH]c1C
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.122g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
229.283g/mol
Monoisotopic Mass:
229.122g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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