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Home Other Building Blocks trans-4-[4-(7-Aminopyrazolo[1,5-a]pyrimidin-6-yl)phenyl]cyclohexaneacetic acid

trans-4-[4-(7-Aminopyrazolo[1,5-a]pyrimidin-6-yl)phenyl]cyclohexaneacetic acid

CAS No.:
1031336-60-3
Catalog Number:
AG008TD7
Molecular Formula:
C20H22N4O2
Molecular Weight:
350.4143
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
99%
1 week
United States
$465
- +
10mg
99%
1 week
United States
$773
- +
50mg
99%
1 week
United States
$2626
- +
100mg
99%
1 week
United States
$3826
- +
Product Description
Catalog Number:
AG008TD7
Chemical Name:
trans-4-[4-(7-Aminopyrazolo[1,5-a]pyrimidin-6-yl)phenyl]cyclohexaneacetic acid
CAS Number:
1031336-60-3
Molecular Formula:
C20H22N4O2
Molecular Weight:
350.4143
MDL Number:
MFCD22124521
IUPAC Name:
2-[4-[4-(7-aminopyrazolo[1,5-a]pyrimidin-6-yl)phenyl]cyclohexyl]acetic acid
InChI:
InChI=1S/C20H22N4O2/c21-20-17(12-22-18-9-10-23-24(18)20)16-7-5-15(6-8-16)14-3-1-13(2-4-14)11-19(25)26/h5-10,12-14H,1-4,11,21H2,(H,25,26)
InChI Key:
BWUXSHHOKODNAK-UHFFFAOYSA-N
SMILES:
OC(=O)CC1CCC(CC1)c1ccc(cc1)c1cnc2n(c1N)ncc2
Properties
Complexity:
486  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
350.174g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
350.422g/mol
Monoisotopic Mass:
350.174g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
93.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Literature
Title Journal
Identification and preliminary characterization of a potent, safe, and orally efficacious inhibitor of acyl-CoA:diacylglycerol acyltransferase 1. Journal of medicinal chemistry 20120223
Properties