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LY364947 10mg

CAT: 0628-A13446-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0628-A13446-10Size:10 mg
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CAS Number
396129-53-6

Chemical Information

Ly-364947

LY 364947 is a member of the class of pyrazoles carrying pyridin-2-yl and quinolin-4-yl substituents at positions 3 and 4 respectively. It has a role as a TGFbeta receptor antagonist. It is a member of pyrazoles, a member of pyridines and a member of quinolines.

CAS Number396129-53-6
PubChem CID447966
IUPAC Name4-(5-pyridin-2-yl-1H-pyrazol-4-yl)quinoline
Molecular FormulaC17H12N4
Molecular Weight272.30
XLogP2.7
Topological Polar Surface Area54.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count21
Formal Charge0
Complexity348
SMILES
C1=CC=C2C(=C1)C(=CC=N2)C3=C(NN=C3)C4=CC=CC=N4
InChI
InChI=1S/C17H12N4/c1-2-6-15-13(5-1)12(8-10-19-15)14-11-20-21-17(14)16-7-3-4-9-18-16/h1-11H,(H,20,21)
InChIKey
IBCXZJCWDGCXQT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ly-364947
CAS: 396129-53-6
CID: 447966
Formula: C17H12N4
MW: 272.30
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight272.30
XLogP32.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass272.106196400
Monoisotopic Mass272.106196400
Topological Polar Surface Area54.5 Ų
Heavy Atom Count21
Formal Charge0
Complexity348
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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