Home Fluorides 1613051-28-7
1613051-28-7,MFCD07838533
Catalog No.:AA01EM2K

1613051-28-7 | (2E)-3-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]prop-2-enoic acid

Pack Size
Purity
Availability
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50mg
95%
3 weeks  
$233.00   $163.00
- +
100mg
95%
3 weeks  
$290.00   $203.00
- +
250mg
95%
3 weeks  
$368.00   $258.00
- +
500mg
95%
3 weeks  
$599.00   $419.00
- +
1g
95%
3 weeks  
$777.00   $544.00
- +
2.5g
95%
3 weeks  
$1,411.00   $988.00
- +
  • Technical Information
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA01EM2K
Chemical Name:
(2E)-3-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]prop-2-enoic acid
CAS Number:
1613051-28-7
Molecular Formula:
C12H8FNO2S
Molecular Weight:
249.2608
MDL Number:
MFCD07838533
SMILES:
OC(=O)/C=C/c1csc(n1)c1ccc(cc1)F
Properties
Computed Properties
 
Complexity:
303  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
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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Tags:1613051-28-7 Molecular Formula|1613051-28-7 MDL|1613051-28-7 SMILES|1613051-28-7 (2E)-3-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]prop-2-enoic acid