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Home > Imidazoles > 1087784-48-2
1087784-48-2 | N-{[4-(2-methylpropanamido)phenyl]methyl}-1H-imidazole-1-carboxamide
CAS No: 1087784-48-2 Catalog No: AG019MY5 MDL No:MFCD11099585
Product Description
Catalog Number:
AG019MY5
Chemical Name:
N-{[4-(2-methylpropanamido)phenyl]methyl}-1H-imidazole-1-carboxamide
CAS Number:
1087784-48-2
Molecular Formula:
C15H18N4O2
Molecular Weight:
286.3290
MDL Number:
MFCD11099585
IUPAC Name:
N-[[4-(2-methylpropanoylamino)phenyl]methyl]imidazole-1-carboxamide
InChI:
InChI=1S/C15H18N4O2/c1-11(2)14(20)18-13-5-3-12(4-6-13)9-17-15(21)19-8-7-16-10-19/h3-8,10-11H,9H2,1-2H3,(H,17,21)(H,18,20)
InChI Key:
NISVVHIPJYVFOS-UHFFFAOYSA-N
SMILES:
O=C(C(C)C)Nc1ccc(cc1)CNC(=O)n1cncc1
Properties
Complexity:
365
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.143g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
286.335g/mol
Monoisotopic Mass:
286.143g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
76A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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