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830-89-7,MFCD00865326
Catalog No.:AA00G75D

830-89-7 | Albutoin

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
95%
in stock  
$341.00   $239.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00G75D
Chemical Name:
Albutoin
CAS Number:
830-89-7
Molecular Formula:
C10H16N2OS
Molecular Weight:
212.3118
MDL Number:
MFCD00865326
SMILES:
C=CCN1C(=S)NC(C1=O)CC(C)C
Properties
Computed Properties
 
Complexity:
263  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.1  

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: Pharmacologic interactions of albutoin with other anticonvulsant drugs.

Journal: The Journal of pharmacology and experimental therapeutics 19700801

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SDS
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Tags:830-89-7 Molecular Formula|830-89-7 MDL|830-89-7 SMILES|830-89-7 Albutoin
Catalog No.: AA00G75D
830-89-7,MFCD00865326
830-89-7 | Albutoin
Pack Size： 50mg
Purity： 95%
in stock
$341.00 $239.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00G75D
Chemical Name: Albutoin
CAS Number: 830-89-7
Molecular Formula: C10H16N2OS
Molecular Weight: 212.3118
MDL Number: MFCD00865326
SMILES: C=CCN1C(=S)NC(C1=O)CC(C)C
Properties
Complexity: 263  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 14  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 1  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.1  
Literature fold

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

Journal: Bioorganic & medicinal chemistry letters20101101

Title: Pharmacologic interactions of albutoin with other anticonvulsant drugs.

Journal: The Journal of pharmacology and experimental therapeutics19700801

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