735342-69-5,MFCD00656058
Catalog No.:AA00ICC3

735342-69-5 | 2-[cyclohexyl(methyl)carbamoyl]benzoic acid

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  • Technical Information
  • Properties
  • Literature
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Technical Information
Catalog Number:
AA00ICC3
Chemical Name:
2-[cyclohexyl(methyl)carbamoyl]benzoic acid
CAS Number:
735342-69-5
Molecular Formula:
C15H19NO3
Molecular Weight:
261.3163
MDL Number:
MFCD00656058
SMILES:
CN(C(=O)c1ccccc1C(=O)O)C1CCCCC1
Properties
Computed Properties
 
Complexity:
336  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.7  

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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SDS
Tags:735342-69-5 Molecular Formula|735342-69-5 MDL|735342-69-5 SMILES|735342-69-5 2-[cyclohexyl(methyl)carbamoyl]benzoic acid
Catalog No.: AA00ICC3
735342-69-5,MFCD00656058
735342-69-5 | 2-[cyclohexyl(methyl)carbamoyl]benzoic acid
This product is typically in stock,please click "Inquire" below or contact us at [email protected]for pricing and availability information.
Inquire
Technical Information
Catalog Number: AA00ICC3
Chemical Name: 2-[cyclohexyl(methyl)carbamoyl]benzoic acid
CAS Number: 735342-69-5
Molecular Formula: C15H19NO3
Molecular Weight: 261.3163
MDL Number: MFCD00656058
SMILES: CN(C(=O)c1ccccc1C(=O)O)C1CCCCC1
Properties
Complexity: 336  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 19  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.7  
Literature fold

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters20101101

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