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MS049

CAS No.:
1502816-23-0
Catalog Number:
AG00ABST
Molecular Formula:
C15H24N2O
Molecular Weight:
248.3639
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
98%
1 week
United States
$140
- +
10mg
98%
1 week
United States
$196
- +
25mg
98%
1 week
United States
$362
- +
50mg
98%
1 week
United States
$612
- +
100mg
98%
1 week
United States
$1098
- +
Product Description
Catalog Number:
AG00ABST
Chemical Name:
MS049
CAS Number:
1502816-23-0
Molecular Formula:
C15H24N2O
Molecular Weight:
248.3639
MDL Number:
MFCD30489737
IUPAC Name:
N-methyl-2-(4-phenylmethoxypiperidin-1-yl)ethanamine
InChI:
InChI=1S/C15H24N2O/c1-16-9-12-17-10-7-15(8-11-17)18-13-14-5-3-2-4-6-14/h2-6,15-16H,7-13H2,1H3
InChI Key:
HBOJWAYLSJLULG-UHFFFAOYSA-N
SMILES:
CNCCN1CCC(CC1)OCc1ccccc1
Properties
Complexity:
209  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.189g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
248.37g/mol
Monoisotopic Mass:
248.189g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
24.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Literature
Title Journal
Discovery of a Potent, Selective, and Cell-Active Dual Inhibitor of Protein Arginine Methyltransferase 4 and Protein Arginine Methyltransferase 6. Journal of medicinal chemistry 20161013
Properties