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Home > Imidazoles > 88934-00-3
88934-00-3 | 1H-Imidazole-4-carboxamide, N-(3,5-dimethoxyphenyl)-5-methyl-
CAS No: 88934-00-3 Catalog No: AG00480A MDL No:
Product Description
Catalog Number:
AG00480A
Chemical Name:
1H-Imidazole-4-carboxamide, N-(3,5-dimethoxyphenyl)-5-methyl-
CAS Number:
88934-00-3
Molecular Formula:
C13H15N3O3
Molecular Weight:
261.2765
IUPAC Name:
N-(3,5-dimethoxyphenyl)-5-methyl-1H-imidazole-4-carboxamide
InChI:
InChI=1S/C13H15N3O3/c1-8-12(15-7-14-8)13(17)16-9-4-10(18-2)6-11(5-9)19-3/h4-7H,1-3H3,(H,14,15)(H,16,17)
InChI Key:
FJHYBXROIBUGEH-UHFFFAOYSA-N
SMILES:
COc1cc(cc(c1)OC)NC(=O)c1nc[nH]c1C
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.111g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
261.281g/mol
Monoisotopic Mass:
261.111g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
76.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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