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Home Carboxys 1-Cyclohexylbenzodiazole-5-carboxylic acid

1-Cyclohexylbenzodiazole-5-carboxylic acid

CAS No.:
669070-72-8
Catalog Number:
AG00FGY6
Molecular Formula:
C14H16N2O2
Molecular Weight:
244.2890
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
10g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG00FGY6
Chemical Name:
1-Cyclohexylbenzodiazole-5-carboxylic acid
CAS Number:
669070-72-8
Molecular Formula:
C14H16N2O2
Molecular Weight:
244.2890
MDL Number:
MFCD03830162
IUPAC Name:
1-cyclohexylbenzimidazole-5-carboxylic acid
InChI:
InChI=1S/C14H16N2O2/c17-14(18)10-6-7-13-12(8-10)15-9-16(13)11-4-2-1-3-5-11/h6-9,11H,1-5H2,(H,17,18)
InChI Key:
VDTQDVBTYFQIPB-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(c1)ncn2C1CCCCC1
Properties
Complexity:
315  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.121g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
244.294g/mol
Monoisotopic Mass:
244.121g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Non-nucleoside inhibitors of the hepatitis C virus NS5B polymerase: discovery and preliminary SAR of benzimidazole derivatives. Bioorganic & medicinal chemistry letters 20040105
Properties