554425-50-2,MFCD03985195
Catalog No.:AA019I5R

554425-50-2 | 4-oxo-3-pentyl-3,4-dihydrophthalazine-1-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
97%
3 weeks  
$124.00   $87.00
- +
100mg
97%
3 weeks  
$156.00   $109.00
- +
250mg
97%
3 weeks  
$199.00   $139.00
- +
500mg
97%
3 weeks  
$279.00   $195.00
- +
1g
97%
3 weeks  
$342.00   $239.00
- +
2.5g
97%
3 weeks  
$618.00   $433.00
- +
5g
97%
3 weeks  
$888.00   $622.00
- +
10g
97%
3 weeks  
$1,286.00   $900.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA019I5R
Chemical Name:
4-oxo-3-pentyl-3,4-dihydrophthalazine-1-carboxylic acid
CAS Number:
554425-50-2
Molecular Formula:
C14H16N2O3
Molecular Weight:
260.2884
MDL Number:
MFCD03985195
SMILES:
CCCCCn1nc(C(=O)O)c2c(c1=O)cccc2
Properties
Computed Properties
 
Complexity:
392  
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:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
5  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.6  

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
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Tags:554425-50-2 Molecular Formula|554425-50-2 MDL|554425-50-2 SMILES|554425-50-2 4-oxo-3-pentyl-3,4-dihydrophthalazine-1-carboxylic acid
Catalog No.: AA019I5R
554425-50-2,MFCD03985195
554425-50-2 | 4-oxo-3-pentyl-3,4-dihydrophthalazine-1-carboxylic acid
Pack Size: 50mg
Purity: 97%
3 weeks
$124.00 $87.00
Pack Size: 100mg
Purity: 97%
3 weeks
$156.00 $109.00
Pack Size: 250mg
Purity: 97%
3 weeks
$199.00 $139.00
Pack Size: 500mg
Purity: 97%
3 weeks
$279.00 $195.00
Pack Size: 1g
Purity: 97%
3 weeks
$342.00 $239.00
Pack Size: 2.5g
Purity: 97%
3 weeks
$618.00 $433.00
Pack Size: 5g
Purity: 97%
3 weeks
$888.00 $622.00
Pack Size: 10g
Purity: 97%
3 weeks
$1,286.00 $900.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA019I5R
Chemical Name: 4-oxo-3-pentyl-3,4-dihydrophthalazine-1-carboxylic acid
CAS Number: 554425-50-2
Molecular Formula: C14H16N2O3
Molecular Weight: 260.2884
MDL Number: MFCD03985195
SMILES: CCCCCn1nc(C(=O)O)c2c(c1=O)cccc2
Properties
Complexity: 392  
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: 4  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 5  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.6  
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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