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160388-53-4,MFCD07186451
Catalog No.:AA001RT4

160388-53-4 | 4-(1H-Pyrazol-1-ylmethyl)benzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95+%
2 weeks  
$67.00   $47.00
- +
250mg
95+%
2 weeks  
$83.00   $58.00
- +
1g
95+%
2 weeks  
$138.00   $97.00
- +
2.5g
95+%
2 weeks  
$232.00   $163.00
- +
5g
95+%
2 weeks  
$313.00   $219.00
- +
10g
95+%
2 weeks  
$541.00   $379.00
- +
  • Technical Information
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  • Technical Information
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Technical Information
Catalog Number:
AA001RT4
Chemical Name:
4-(1H-Pyrazol-1-ylmethyl)benzoic acid
CAS Number:
160388-53-4
Molecular Formula:
C11H10N2O2
Molecular Weight:
202.2093
MDL Number:
MFCD07186451
SMILES:
OC(=O)c1ccc(cc1)Cn1cccn1
Properties
Computed Properties
 
Complexity:
225  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
1.3  

Literature

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

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: A structure-permeability study of small drug-like molecules.

Journal: Bioorganic & medicinal chemistry letters 20030224

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SDS
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Tags:160388-53-4 Molecular Formula|160388-53-4 MDL|160388-53-4 SMILES|160388-53-4 4-(1H-Pyrazol-1-ylmethyl)benzoic acid