CEP-33779

CAT: 1568-C08874-02Size: 1 gDry Ice: YesHazardous: No

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CAT#:1568-C08874-02Size:1 g

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

1257704-57-6

SKU

C08874-5mg

Target

JAK

Applications

Angiogenesis

Smiles

CN1CCN (CC1) C2=CC=CC (=C2) NC3=NN4C=CC=C (C4=N3) C5=CC=C (C=C5) S (=O) (=O) C

Molecular Formula

C24H26N6O2S

Additionnal Information

CEP33779 is a selective JAK2 inhibitor with IC50 of 1.8 nM, >40- and >800-fold versus JAK1 and TYK2.

Storage Conditions

2 years -80 in solvent

Chemical Information

Cep-33779

CAS Number	1257704-57-6
PubChem CID	57336812
IUPAC Name	N-[3-(4-methylpiperazin-1-yl)phenyl]-8-(4-methylsulfonylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
Molecular Formula	C24H26N6O2S
Molecular Weight	462.6
XLogP	3.4
Topological Polar Surface Area	91.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	5
Heavy Atom Count	33
Formal Charge	0
Complexity	745

SMILES

CN1CCN(CC1)C2=CC=CC(=C2)NC3=NN4C=CC=C(C4=N3)C5=CC=C(C=C5)S(=O)(=O)C

InChI

InChI=1S/C24H26N6O2S/c1-28-13-15-29(16-14-28)20-6-3-5-19(17-20)25-24-26-23-22(7-4-12-30(23)27-24)18-8-10-21(11-9-18)33(2,31)32/h3-12,17H,13-16H2,1-2H3,(H,25,27)

InChIKey

RFZKSQIFOZZIAQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1257704-57-6

CID: 57336812

Formula: C24H26N6O2S

MW: 462.6

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	462.6
XLogP3	3.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	5
Exact Mass	462.18379527
Monoisotopic Mass	462.18379527
Topological Polar Surface Area	91.2 Å²
Heavy Atom Count	33
Formal Charge	0
Complexity	745
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
A4146-50	CEP-33779
FC137660-01	CEP 33779
HY-15343R-01	CEP-33779 (Standard)

CEP-33779

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