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Home > Imidazoles > 88933-93-1
88933-93-1 | 1H-Imidazole-4-carboxamide, N-[(4-methoxyphenyl)methyl]-5-methyl-
CAS No: 88933-93-1 Catalog No: AG00480C MDL No:
Product Description
Catalog Number:
AG00480C
Chemical Name:
1H-Imidazole-4-carboxamide, N-[(4-methoxyphenyl)methyl]-5-methyl-
CAS Number:
88933-93-1
Molecular Formula:
C13H15N3O2
Molecular Weight:
245.2771
IUPAC Name:
N-[(4-methoxyphenyl)methyl]-5-methyl-1H-imidazole-4-carboxamide
InChI:
InChI=1S/C13H15N3O2/c1-9-12(16-8-15-9)13(17)14-7-10-3-5-11(18-2)6-4-10/h3-6,8H,7H2,1-2H3,(H,14,17)(H,15,16)
InChI Key:
LILIXKHKJSAQGO-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)CNC(=O)c1nc[nH]c1C
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.116g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
245.282g/mol
Monoisotopic Mass:
245.116g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
67A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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