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88933-82-8 | 1H-Imidazole-4-carboxamide, N-(4-fluorophenyl)-5-methyl-
CAS No: 88933-82-8 Catalog No: AG00480F MDL No:
Product Description
Catalog Number:
AG00480F
Chemical Name:
1H-Imidazole-4-carboxamide, N-(4-fluorophenyl)-5-methyl-
CAS Number:
88933-82-8
Molecular Formula:
C11H10FN3O
Molecular Weight:
219.2150
IUPAC Name:
N-(4-fluorophenyl)-5-methyl-1H-imidazole-4-carboxamide
InChI:
InChI=1S/C11H10FN3O/c1-7-10(14-6-13-7)11(16)15-9-4-2-8(12)3-5-9/h2-6H,1H3,(H,13,14)(H,15,16)
InChI Key:
JNXVKVYNWQGXCM-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)NC(=O)c1nc[nH]c1C
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.081g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
219.219g/mol
Monoisotopic Mass:
219.081g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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