CE-224535

CAT: 0931-T14920-08Size: 200 mgDry Ice: NoHazardous: No

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CAT#:0931-T14920-08Size:200 mg

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

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CAS Number

724424-43-5

Target

P2X Receptor

Related Pathways

Membrane transporter/Ion channel, Neuroscience

Purity

0.9968

Bioactivity

CE-224535 (PF-04905428) is a selective antagonist of P2X7 receptor. CE-224535 can be used in disease-modifying antirheumatic studies.

Smiles

COC[C@H](O)Cn1c(=O)cnn(-c2ccc(Cl)c(c2)C(=O)NCC2(O)CCCCCC2)c1=O

Molecular Formula

C22H29ClN4O6

Molecular Weight

480.94

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Ce-224535

CE-224535 has been used in trials studying the treatment of Osteoarthritis.

CAS Number	724424-43-5
PubChem CID	11547499
IUPAC Name	2-chloro-N-[(1-hydroxycycloheptyl)methyl]-5-[4-[(2R)-2-hydroxy-3-methoxypropyl]-3,5-dioxo-1,2,4-triazin-2-yl]benzamide
Molecular Formula	C22H29ClN4O6
Molecular Weight	480.9
XLogP	1.6
Topological Polar Surface Area	132
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	8
Heavy Atom Count	33
Formal Charge	0
Complexity	742

SMILES

COC[C@@H](CN1C(=O)C=NN(C1=O)C2=CC(=C(C=C2)Cl)C(=O)NCC3(CCCCCC3)O)O

InChI

InChI=1S/C22H29ClN4O6/c1-33-13-16(28)12-26-19(29)11-25-27(21(26)31)15-6-7-18(23)17(10-15)20(30)24-14-22(32)8-4-2-3-5-9-22/h6-7,10-11,16,28,32H,2-5,8-9,12-14H2,1H3,(H,24,30)/t16-/m1/s1

InChIKey

FUCKCIVGBCBZNP-MRXNPFEDSA-N

Chemical Structure

2D Structure

CAS: 724424-43-5

CID: 11547499

Formula: C22H29ClN4O6

MW: 480.9

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	480.9
XLogP3	1.6
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	8
Exact Mass	480.1775624
Monoisotopic Mass	480.1775624
Topological Polar Surface Area	132 Å²
Heavy Atom Count	33
Formal Charge	0
Complexity	742
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
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
MBS5768880	CE-224535
FC158497	CE 224535
A21183-5	CE-224535 5mg
A21183-1	CE-224535 1mg
TRC-C394501-75MG	CE-224535-¹³CD₃
A21183-200	CE-224535 200mg
A21183-100	CE-224535 100mg
A21183-50	CE-224535 50mg
A21183-25	CE-224535 25mg
A21183-10	CE-224535 10mg

CE-224535

Chemical Information

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