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ULK-101

CAT: 1568-C13676-5mgSize: 5 mgDry Ice: NoHazardous: No
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CAT#:1568-C13676-5mgSize:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2443816-45-1
Target
ULK
Applications
Autophagy
Smiles
FC1=CC=C (C=C1) C2=C[N]3N=CC (=C3N=C2) C4=CSC (=C4) C (=O) NC (C5CC5) C (F) (F) F
Molecular Formula
C22H16F4N4OS
Additionnal Information
ULK-101 is a potent and selective ULK1 inhibitor with IC50 values of 8.3 nM and 30 nM for ULK1 and ULK2, respectively.
Storage Conditions
3 years -20°C powder

Chemical Information

(S)-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-(6-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidin-3-yl)thiophene-2-carboxamide
CAS Number2443816-45-1
PubChem CID137628686
IUPAC NameN-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-[6-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidin-3-yl]thiophene-2-carboxamide
Molecular FormulaC22H16F4N4OS
Molecular Weight460.4
XLogP4.9
Topological Polar Surface Area87.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Heavy Atom Count32
Formal Charge0
Complexity685
SMILES
C1CC1[C@@H](C(F)(F)F)NC(=O)C2=CC(=CS2)C3=C4N=CC(=CN4N=C3)C5=CC=C(C=C5)F
InChI
InChI=1S/C22H16F4N4OS/c23-16-5-3-12(4-6-16)15-8-27-20-17(9-28-30(20)10-15)14-7-18(32-11-14)21(31)29-19(13-1-2-13)22(24,25)26/h3-11,13,19H,1-2H2,(H,29,31)/t19-/m0/s1
InChIKey
PFZRXJIYAFANHP-IBGZPJMESA-N
Chemical Structure
2D Structure
2D structure of (S)-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-(6-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidin-3-yl)thiophene-2-carboxamide
CAS: 2443816-45-1
CID: 137628686
Formula: C22H16F4N4OS
MW: 460.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight460.4
XLogP34.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Exact Mass460.09809497
Monoisotopic Mass460.09809497
Topological Polar Surface Area87.5 Ų
Heavy Atom Count32
Formal Charge0
Complexity685
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
BA3699-10ULK-101
FU172886-01ULK 101
M16933ULK-100
529487-01ULK, phosphorylated (Ser317)
MBS9600629-01Phospho-ULK(Ser317) Antibody

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