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Home > Imidazoles > 88933-91-9
88933-91-9 | 1H-Imidazole-4-carboxamide, 5-methyl-N-[2-(4-methylphenyl)ethyl]-
CAS No: 88933-91-9 Catalog No: AG0048UM MDL No:
Product Description
Catalog Number:
AG0048UM
Chemical Name:
1H-Imidazole-4-carboxamide, 5-methyl-N-[2-(4-methylphenyl)ethyl]-
CAS Number:
88933-91-9
Molecular Formula:
C14H17N3O
Molecular Weight:
243.3043
IUPAC Name:
5-methyl-N-[2-(4-methylphenyl)ethyl]-1H-imidazole-4-carboxamide
InChI:
InChI=1S/C14H17N3O/c1-10-3-5-12(6-4-10)7-8-15-14(18)13-11(2)16-9-17-13/h3-6,9H,7-8H2,1-2H3,(H,15,18)(H,16,17)
InChI Key:
HYBTVTFYWMLWDA-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)CCNC(=O)c1nc[nH]c1C
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.137g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
243.31g/mol
Monoisotopic Mass:
243.137g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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