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Home > Imidazoles > 88933-79-3
88933-79-3 | 1H-Imidazole-4-carboxamide, N-ethyl-5-methyl-N-phenyl-
CAS No: 88933-79-3 Catalog No: AG008A18 MDL No:
Product Description
Catalog Number:
AG008A18
Chemical Name:
1H-Imidazole-4-carboxamide, N-ethyl-5-methyl-N-phenyl-
CAS Number:
88933-79-3
Molecular Formula:
C13H15N3O
Molecular Weight:
229.2777
IUPAC Name:
N-ethyl-5-methyl-N-phenyl-1H-imidazole-4-carboxamide
InChI:
InChI=1S/C13H15N3O/c1-3-16(11-7-5-4-6-8-11)13(17)12-10(2)14-9-15-12/h4-9H,3H2,1-2H3,(H,14,15)
InChI Key:
LFWLCCHDSSENTM-UHFFFAOYSA-N
SMILES:
CCN(C(=O)c1nc[nH]c1C)c1ccccc1
Properties
Complexity:
263
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:
1
Isotope Atom Count:
0
Molecular Weight:
229.283g/mol
Monoisotopic Mass:
229.122g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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