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86796-30-7 | 4H-Pyrazolo[1,5-a]benzimidazole-3-carboxamide(9CI)
CAS No: 86796-30-7 Catalog No: AG004N2S MDL No:
Product Description
Catalog Number:
AG004N2S
Chemical Name:
4H-Pyrazolo[1,5-a]benzimidazole-3-carboxamide(9CI)
CAS Number:
86796-30-7
Molecular Formula:
C10H8N4O
Molecular Weight:
200.1967
IUPAC Name:
1H-pyrazolo[1,5-a]benzimidazole-3-carboxamide
InChI:
InChI=1S/C10H8N4O/c11-9(15)6-5-12-14-8-4-2-1-3-7(8)13-10(6)14/h1-5,12H,(H2,11,15)
InChI Key:
IFUAAAVKKXABRR-UHFFFAOYSA-N
SMILES:
NC(=O)c1cnn2c1[nH]c1c2cccc1
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.07g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
200.201g/mol
Monoisotopic Mass:
200.07g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
76.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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