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636574-49-7 | 1H-Benzimidazole-4-carboxamide,2-(methylthio)-
CAS No: 636574-49-7 Catalog No: AG00EGOG MDL No:
Product Description
Catalog Number:
AG00EGOG
Chemical Name:
1H-Benzimidazole-4-carboxamide,2-(methylthio)-
CAS Number:
636574-49-7
IUPAC Name:
2-methylsulfanyl-1H-benzimidazole-4-carboxamide
InChI:
InChI=1S/C9H9N3OS/c1-14-9-11-6-4-2-3-5(8(10)13)7(6)12-9/h2-4H,1H3,(H2,10,13)(H,11,12)
InChI Key:
WQTMLBRKKDOVKP-UHFFFAOYSA-N
Properties
Complexity:
236
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.047g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
207.251g/mol
Monoisotopic Mass:
207.047g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
97.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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