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Home > Imidazoles > 825615-92-7
825615-92-7 | Benzamide, N-[3-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-
CAS No: 825615-92-7 Catalog No: AG008KLY MDL No:
Product Description
Catalog Number:
AG008KLY
Chemical Name:
Benzamide, N-[3-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-
CAS Number:
825615-92-7
Molecular Formula:
C17H13N5O
Molecular Weight:
303.3180
IUPAC Name:
N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]benzamide
InChI:
InChI=1S/C17H13N5O/c23-17(11-6-2-1-3-7-11)21-14-10-18-22-15(14)16-19-12-8-4-5-9-13(12)20-16/h1-10H,(H,18,22)(H,19,20)(H,21,23)
InChI Key:
FPKSFXFWECAIBR-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)Nc1c[nH]nc1c1nc2c([nH]1)cccc2
Properties
Complexity:
425
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.112g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
303.325g/mol
Monoisotopic Mass:
303.112g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
86.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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