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Home Other Building Blocks 1382481-79-9
1382481-79-9,MFCD25541754
Catalog No.:AA00AAV2

1382481-79-9 | [(3R)-3-(Hydroxymethyl)-1-piperidinyl][4-[2-(4-methoxyphenyl)ethynyl]phenyl]-methanone

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
≥98%
in stock  
$53.00   $37.00
- +
5mg
≥98%
in stock  
$129.00   $90.00
- +
10mg
≥98%
in stock  
$230.00   $161.00
- +
25mg
in stock  
$473.00   $331.00
- +
50mg
in stock  
$761.00   $533.00
- +
100mg
in stock  
$1,270.00   $889.00
- +
500mg
in stock  
$3,958.00   $2,771.00
- +
1000mg
in stock  
$6,295.00   $4,407.00
- +
  • Technical Information
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA00AAV2
Chemical Name:
[(3R)-3-(Hydroxymethyl)-1-piperidinyl][4-[2-(4-methoxyphenyl)ethynyl]phenyl]-methanone
CAS Number:
1382481-79-9
Molecular Formula:
C22H23NO3
Molecular Weight:
349.4229
MDL Number:
MFCD25541754
SMILES:
OC[C@@H]1CCCN(C1)C(=O)c1ccc(cc1)C#Cc1ccc(cc1)OC
Properties
Computed Properties
 
Complexity:
518  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
5  
XLogP3:
3.4  

Literature

Title: Discovery of (R)-(2-fluoro-4-((-4-methoxyphenyl)ethynyl)phenyl) (3-hydroxypiperidin-1-yl)methanone (ML337), an mGlu3 selective and CNS penetrant negative allosteric modulator (NAM).

Journal: Journal of medicinal chemistry 20130627

Title: Development of a novel, CNS-penetrant, metabotropic glutamate receptor 3 (mGlu3) NAM probe (ML289) derived from a closely related mGlu5 PAM.

Journal: Bioorganic & medicinal chemistry letters 20120615

Title: Sheffler DJ, et al. Development of a novel, CNS-penetrant, metabotropic glutamate receptor 3 (mGlu3) NAM probe (ML289) derived from a closely related mGlu5 PAM. Bioorg Med Chem Lett. 2012;22(12):3921-3925.

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Tags:1382481-79-9 Molecular Formula|1382481-79-9 MDL|1382481-79-9 SMILES|1382481-79-9 [(3R)-3-(Hydroxymethyl)-1-piperidinyl][4-[2-(4-methoxyphenyl)ethynyl]phenyl]-methanone