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200112-19-2 | 1H-Benzimidazole-6-carboximidamide, 2-(2-pyridinyl)-
CAS No: 200112-19-2 Catalog No: AG002CK4 MDL No:
Product Description
Catalog Number:
AG002CK4
Chemical Name:
1H-Benzimidazole-6-carboximidamide, 2-(2-pyridinyl)-
CAS Number:
200112-19-2
Molecular Formula:
C13H11N5
Molecular Weight:
237.2599
IUPAC Name:
2-pyridin-2-yl-3H-benzimidazole-5-carboximidamide
InChI:
InChI=1S/C13H11N5/c14-12(15)8-4-5-9-11(7-8)18-13(17-9)10-3-1-2-6-16-10/h1-7H,(H3,14,15)(H,17,18)
InChI Key:
RVIFTTGMSLOWED-UHFFFAOYSA-N
SMILES:
NC(=N)c1ccc2c(c1)[nH]c(n2)c1ccccn1
Properties
Complexity:
319
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.101g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
237.266g/mol
Monoisotopic Mass:
237.101g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
91.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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