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BMS986260

CAT: 0931-T8730-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T8730-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2001559-19-7
Target
TGF-beta/Smad
Related Pathways
Stem Cells
Purity
0.9822
Bioactivity
BMS-986260 is a selective, and orally bioavailable TGFβR1 inhibitor (IC50 = 1.6 nM) .
Smiles
C(CO)N1C(=C(N=C1)C2=CC(Cl)=C(F)C=C2)C3=NN4C(C=C3)=NC=C4C#N
Molecular Formula
C18H12ClFN6O
Molecular Weight
382.78
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Bms-986260
CAS Number2001559-19-7
PubChem CID122510453
IUPAC Name6-[5-(3-chloro-4-fluorophenyl)-3-(2-hydroxyethyl)imidazol-4-yl]imidazo[1,2-b]pyridazine-3-carbonitrile
Molecular FormulaC18H12ClFN6O
Molecular Weight382.8
XLogP1.8
Topological Polar Surface Area92
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count27
Formal Charge0
Complexity575
SMILES
C1=CC(=C(C=C1C2=C(N(C=N2)CCO)C3=NN4C(=NC=C4C#N)C=C3)Cl)F
InChI
InChI=1S/C18H12ClFN6O/c19-13-7-11(1-2-14(13)20)17-18(25(5-6-27)10-23-17)15-3-4-16-22-9-12(8-21)26(16)24-15/h1-4,7,9-10,27H,5-6H2
InChIKey
VZZBCNXVZFAIQX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Bms-986260
CAS: 2001559-19-7
CID: 122510453
Formula: C18H12ClFN6O
MW: 382.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight382.8
XLogP31.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass382.0745149
Monoisotopic Mass382.0745149
Topological Polar Surface Area92 Ų
Heavy Atom Count27
Formal Charge0
Complexity575
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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