TH152

CAT: 0931-T203365-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0931-T203365-01Size:10 mg

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

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CAS Number

1622917-95-6

Target

ATG, Others

Related Pathways

Others, Autophagy

Bioactivity

TH152 is a general reversible ligand for LC3/GABARAP with a dissociation constant (KD) of 2 μM. LC3/GABARAP is a protein associated with autophagy.

Smiles

O=C(O)C=1C=CC(=CC1)C=2N=C(SC2)NC3=NC(=NC(Cl)=C3)SC(C(=O)O)CCCCCC

Molecular Formula

C22H23ClN4O4S2

Molecular Weight

507.03

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

4-[2-[[2-(1-Carboxyheptylsulfanyl)-6-chloropyrimidin-4-yl]amino]-1,3-thiazol-4-yl]benzoic acid

CAS Number	1622917-95-6
PubChem CID	118708871
IUPAC Name	4-[2-[[2-(1-carboxyheptylsulfanyl)-6-chloropyrimidin-4-yl]amino]-1,3-thiazol-4-yl]benzoic acid
Molecular Formula	C22H23ClN4O4S2
Molecular Weight	507.0
XLogP	6.9
Topological Polar Surface Area	179
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	12
Heavy Atom Count	33
Formal Charge	0
Complexity	642

SMILES

CCCCCCC(C(=O)O)SC1=NC(=CC(=N1)Cl)NC2=NC(=CS2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C22H23ClN4O4S2/c1-2-3-4-5-6-16(20(30)31)33-22-25-17(23)11-18(27-22)26-21-24-15(12-32-21)13-7-9-14(10-8-13)19(28)29/h7-12,16H,2-6H2,1H3,(H,28,29)(H,30,31)(H,24,25,26,27)

InChIKey

LWPNKRYFNXAWGF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1622917-95-6

CID: 118708871

Formula: C22H23ClN4O4S2

MW: 507.0

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	507.0
XLogP3	6.9
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	12
Exact Mass	506.0849253
Monoisotopic Mass	506.0849253
Topological Polar Surface Area	179 Å²
Heavy Atom Count	33
Formal Charge	0
Complexity	642
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
HY-168347	TH152

TH152

Chemical Information

Alternative Products

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