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188106-83-4

188106-83-4 | 1h-benzimidazole-7-carboxamide, 2-(4-hydroxyphenyl)-

CAS No: 188106-83-4 Catalog No: AG002GOI MDL No:MFCD11113330

Product Description

Catalog Number:
AG002GOI
Chemical Name:
1h-benzimidazole-7-carboxamide, 2-(4-hydroxyphenyl)-
CAS Number:
188106-83-4
Molecular Formula:
C14H11N3O2
Molecular Weight:
253.2560
MDL Number:
MFCD11113330
IUPAC Name:
2-(4-hydroxyphenyl)-1H-benzimidazole-4-carboxamide
InChI:
InChI=1S/C14H11N3O2/c15-13(19)10-2-1-3-11-12(10)17-14(16-11)8-4-6-9(18)7-5-8/h1-7,18H,(H2,15,19)(H,16,17)
InChI Key:
KOUGHMOSYJCJLE-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)c1nc2c([nH]1)c(ccc2)C(=O)N

Properties

Complexity:
342  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.085g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
253.261g/mol
Monoisotopic Mass:
253.085g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
92A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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