EP2 receptor antagonist-1

CAT: 0931-T62641-01Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0931-T62641-01Size:25 mg

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

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CAS Number

848920-08-1

Target

Prostaglandin Receptor, Others

Related Pathways

Others, Immunology/Inflammation, GPCR/G Protein

Bioactivity

EP2 receptor antagonist-1 is a reversible, potent, agonist-dependent variant of the prostaglandin EP2 receptor antagonist.EP2 receptor antagonist-1 exhibits anti-inflammatory activity.

Smiles

Nc1c(C(=O)OCC2CCCO2)c2nc3ccccc3nc2n1-c1ccc2OCCOc2c1

Molecular Formula

C24H22N4O5

Molecular Weight

446.46

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

EP2 receptor antagonist-1

CAS Number	848920-08-1
PubChem CID	664888
IUPAC Name	oxolan-2-ylmethyl 2-amino-1-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolo[3,2-b]quinoxaline-3-carboxylate
Molecular Formula	C24H22N4O5
Molecular Weight	446.5
XLogP	3.5
Topological Polar Surface Area	111
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	5
Heavy Atom Count	33
Formal Charge	0
Complexity	712

SMILES

C1CC(OC1)COC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)C5=CC6=C(C=C5)OCCO6)N

InChI

InChI=1S/C24H22N4O5/c25-22-20(24(29)33-13-15-4-3-9-30-15)21-23(27-17-6-2-1-5-16(17)26-21)28(22)14-7-8-18-19(12-14)32-11-10-31-18/h1-2,5-8,12,15H,3-4,9-11,13,25H2

InChIKey

OHXALKVNKANGKL-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 848920-08-1

CID: 664888

Formula: C24H22N4O5

MW: 446.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	446.5
XLogP3	3.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	5
Exact Mass	446.15901982
Monoisotopic Mass	446.15901982
Topological Polar Surface Area	111 Å²
Heavy Atom Count	33
Formal Charge	0
Complexity	712
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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HY-10815-01	σ1 Receptor antagonist-1
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HY-149105	FSH receptor antagonist 1
HY-170654	Opioid receptor antagonist 1
HY-130992-01	Androgen receptor antagonist 1
HY-18076-01	LPA1 receptor antagonist 1
HY-141865	Adenosine receptor antagonist 1
547964	Interleukin 1 Receptor Antagonist
320856-01	Interleukin-1 Receptor antagonist

EP2 receptor antagonist-1

Chemical Information

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