LN6023

CAT: 0931-T71472-02Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0931-T71472-02Size:50 mg

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CAS Number

1086713-00-9

Target

Others

Related Pathways

Others

Bioactivity

LN6023 is a ACKR3/CXCR7 Superagonist for Platelet Degranulation Modulation. LN6023 effectively reduced P-selectin expression by up to 97%, suggesting to be a potential candidate for the treatment of platelet-mediated thrombosis.

Smiles

O=C1N2C(SC(NC(C(NCCN3CCCCCC3)=O)C)=N2)=NC(C)=C1

Molecular Formula

C17H26N6O2S

Molecular Weight

378.49

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

N-[2-(1-azepanyl)ethyl]-2-[(7-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)amino]propanamide

CAS Number	1086713-00-9
PubChem CID	20886261
IUPAC Name	N-[2-(azepan-1-yl)ethyl]-2-[(7-methyl-5-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-2-yl)amino]propanamide
Molecular Formula	C17H26N6O2S
Molecular Weight	378.5
XLogP	1.4
Topological Polar Surface Area	115
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	6
Heavy Atom Count	26
Formal Charge	0
Complexity	652

SMILES

CC1=CC(=O)N2C(=N1)SC(=N2)NC(C)C(=O)NCCN3CCCCCC3

InChI

InChI=1S/C17H26N6O2S/c1-12-11-14(24)23-17(19-12)26-16(21-23)20-13(2)15(25)18-7-10-22-8-5-3-4-6-9-22/h11,13H,3-10H2,1-2H3,(H,18,25)(H,20,21)

InChIKey

GYVAEOFCGCEFET-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1086713-00-9

CID: 20886261

Formula: C17H26N6O2S

MW: 378.5

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	378.5
XLogP3	1.4
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	6
Exact Mass	378.18379527
Monoisotopic Mass	378.18379527
Topological Polar Surface Area	115 Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	652
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

Alternative Products

Catalog	Name
MBS5814010	LN6023
HY-172541	LN6023 (hydrochloride)
GTR19263736-01	LN6023 hydrochloride

LN6023

Chemical Information

Alternative Products

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