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Home Other Building Blocks PTC-209 (PTC209

PTC-209 (PTC209

CAS No.:
315704-66-6
Catalog Number:
AG00C6HI
Molecular Formula:
C17H13Br2N5OS
Molecular Weight:
495.1910
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
≥95%
1 week
United States
$87
- +
5mg
≥95%
1 week
United States
$179
- +
10mg
≥95%
1 week
United States
$286
- +
25mg
≥95%
1 week
United States
$554
- +
Product Description
Catalog Number:
AG00C6HI
Chemical Name:
PTC-209 (PTC209
CAS Number:
315704-66-6
Molecular Formula:
C17H13Br2N5OS
Molecular Weight:
495.1910
MDL Number:
MFCD02110649
IUPAC Name:
N-(2,6-dibromo-4-methoxyphenyl)-4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)-1,3-thiazol-2-amine
InChI:
InChI=1S/C17H13Br2N5OS/c1-9-15(24-5-3-4-20-16(24)21-9)13-8-26-17(22-13)23-14-11(18)6-10(25-2)7-12(14)19/h3-8H,1-2H3,(H,22,23)
InChI Key:
XVOOCQSWCCRVDY-UHFFFAOYSA-N
SMILES:
COc1cc(Br)c(c(c1)Br)Nc1scc(n1)c1c(C)nc2n1cccn2
Properties
Complexity:
480  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
494.919g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
495.193g/mol
Monoisotopic Mass:
492.921g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
92.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5  
Literature
Title Journal
SAR and QSAR study on 2-aminothiazole derivatives, modulators of transcriptional repression in Huntington's disease. Bioorganic & medicinal chemistry 20080515
Properties