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MS023

CAS No.:
1831110-54-3
Catalog Number:
AG0024DU
Molecular Formula:
C17H25N3O
Molecular Weight:
287.3999
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
2mg
99%
1 week
United States
$140
- +
5mg
99%
1 week
United States
$196
- +
10mg
99%
1 week
United States
$265
- +
25mg
99%
1 week
United States
$487
- +
50mg
99%
1 week
United States
$723
- +
100mg
99%
1 week
United States
$1098
- +
Product Description
Catalog Number:
AG0024DU
Chemical Name:
MS023
CAS Number:
1831110-54-3
Molecular Formula:
C17H25N3O
Molecular Weight:
287.3999
MDL Number:
MFCD29924734
IUPAC Name:
N'-methyl-N'-[[4-(4-propan-2-yloxyphenyl)-1H-pyrrol-3-yl]methyl]ethane-1,2-diamine
InChI:
InChI=1S/C17H25N3O/c1-13(2)21-16-6-4-14(5-7-16)17-11-19-10-15(17)12-20(3)9-8-18/h4-7,10-11,13,19H,8-9,12,18H2,1-3H3
InChI Key:
FMTVWAGUJRUAKE-UHFFFAOYSA-N
SMILES:
NCCN(Cc1c[nH]cc1c1ccc(cc1)OC(C)C)C
Properties
Complexity:
290  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.2g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
287.407g/mol
Monoisotopic Mass:
287.2g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
54.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
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
An alkyl etherase in rat liver. The Journal of physiology 19751101
Properties