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Home Other Building Blocks 3,5,7,8-Tetrahydro-2-[4-(trifluoromethyl)phenyl]-4H-thiopyrano[4,3-d]pyrimidin-4-one

3,5,7,8-Tetrahydro-2-[4-(trifluoromethyl)phenyl]-4H-thiopyrano[4,3-d]pyrimidin-4-one

CAS No.:
284028-89-3
Catalog Number:
AG0039F6
Molecular Formula:
C14H11F3N2OS
Molecular Weight:
312.3101
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
98%(HPLC)
In Stock USA
United States
$46
- +
5mg
98%(HPLC)
In Stock USA
United States
$82
- +
10mg
98%(HPLC)
In Stock USA
United States
$130
- +
25mg
98%(HPLC)
In Stock USA
United States
$262
- +
Product Description
Catalog Number:
AG0039F6
Chemical Name:
3,5,7,8-Tetrahydro-2-[4-(trifluoromethyl)phenyl]-4H-thiopyrano[4,3-d]pyrimidin-4-one
CAS Number:
284028-89-3
Molecular Formula:
C14H11F3N2OS
Molecular Weight:
312.3101
MDL Number:
MFCD16879017
IUPAC Name:
2-[4-(trifluoromethyl)phenyl]-3,5,7,8-tetrahydrothiopyrano[4,3-d]pyrimidin-4-one
InChI:
InChI=1S/C14H11F3N2OS/c15-14(16,17)9-3-1-8(2-4-9)12-18-11-5-6-21-7-10(11)13(20)19-12/h1-4H,5-7H2,(H,18,19,20)
InChI Key:
KLGQSVMIPOVQAX-UHFFFAOYSA-N
SMILES:
O=c1nc([nH]c2c1CSCC2)c1ccc(cc1)C(F)(F)F
Properties
Complexity:
505  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.054g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
312.31g/mol
Monoisotopic Mass:
312.054g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Literature
Title Journal
WNT7A/β-catenin signaling induces FGF1 and influences sensitivity to niclosamide in ovarian cancer. Oncogene 20150601
Combination effects of AHR agonists and Wnt/β-catenin modulators in zebrafish embryos: Implications for physiological and toxicological AHR functions. Toxicology and applied pharmacology 20150415
Inhibition of canonical WNT signaling attenuates human leiomyoma cell growth. Fertility and sterility 20140501
Biological significance and therapeutic implication of resveratrol-inhibited Wnt, Notch and STAT3 signaling in cervical cancer cells. Genes & cancer 20140501
2,3,7,8-Tetrachlorodibenzo-p-dioxin stimulates proliferation of HAPI microglia by affecting the Akt/GSK-3β/cyclin D1 signaling pathway. Toxicology letters 20140130
Novel binding mode of a potent and selective tankyrase inhibitor. PloS one 20120101
Properties