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128196-02-1,MFCD08063389
Catalog No.:AA009ACQ

128196-02-1 | (R)-(-)-CITALOPRAM

Pack Size
Purity
Availability
Price(USD)
Quantity
  
25mg
2 weeks  
$2,184.00   $1,529.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA009ACQ
Chemical Name:
(R)-(-)-CITALOPRAM
CAS Number:
128196-02-1
Molecular Formula:
C20H21FN2O
Molecular Weight:
324.3919
MDL Number:
MFCD08063389
SMILES:
CN(C)CCCC1(C2=C(CO1)C=C(C=C2)C#N)C3=CC=C(C=C3)F
Properties
Computed Properties
 
Complexity:
466  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
5  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.2  

Literature

Title: In silico prediction of pregnane X receptor activators by machine learning approaches.

Journal: Molecular pharmacology 20070101

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

Title: Prediction of genotoxicity of chemical compounds by statistical learning methods.

Journal: Chemical research in toxicology 20050601

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SDS
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Tags:128196-02-1 Molecular Formula|128196-02-1 MDL|128196-02-1 SMILES|128196-02-1 (R)-(-)-CITALOPRAM
Catalog No.: AA009ACQ
128196-02-1,MFCD08063389
128196-02-1 | (R)-(-)-CITALOPRAM
Pack Size： 25mg
Purity：
2 weeks
$2,184.00 $1,529.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA009ACQ
Chemical Name: (R)-(-)-CITALOPRAM
CAS Number: 128196-02-1
Molecular Formula: C20H21FN2O
Molecular Weight: 324.3919
MDL Number: MFCD08063389
SMILES: CN(C)CCCC1(C2=C(CO1)C=C(C=C2)C#N)C3=CC=C(C=C3)F
Properties
Complexity: 466  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 1  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 24  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 5  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.2  
Literature fold

Title: In silico prediction of pregnane X receptor activators by machine learning approaches.

Journal: Molecular pharmacology20070101

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology20060501

Title: Prediction of genotoxicity of chemical compounds by statistical learning methods.

Journal: Chemical research in toxicology20050601

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