ASP4132

CAT: 0931-T8432-06Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0931-T8432-06Size:50 mg

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

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CAS Number

1640294-30-9

Target

AMPK

Related Pathways

Chromatin/Epigenetic, PI3K/Akt/mTOR signaling

Purity

0.9926

Bioactivity

ASP4132 is an orally active AMPK activator (EC50 : 18 nM), has anti-cancer activity.

Smiles

Cc1ccc(cc1)S(O)(=O)=O.Cc1ccc(cc1)S(O)(=O)=O.COc1ccc(CN2CCC(CC2)c2ccc3nc([nH]c3c2)C(=O)N2CCN(Cc3ccc(cc3)C(F)(F)F)CC2)cn1

Molecular Formula

C46H51F3N6O8S2

Molecular Weight

937.06

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

(6-(1-((6-methoxypyridin-3-yl)methyl)piperidin-4-yl)-1H-benzo(d)imidazol-2-yl)(4-(4-(trifluoromethyl)benzyl)piperazin-1-yl)methanone bis(4-methylbenzenesulfonate)

ASP4132 is a molecule with potential antineoplastic activity. Upon oral administration, ASP4132 affects oxidative phosphorylation in mitochondria of metabolically-active tumor cells, which reduces both energy production and tumor cell proliferation. Mitochondrial oxidative phosphorylation is hyperactivated in tumor cells and plays a key role in the promotion of tumor cell proliferation.

CAS Number	1640294-30-9
PubChem CID	146673134
IUPAC Name	[6-[1-[(6-methoxy-3-pyridinyl)methyl]piperidin-4-yl]-1H-benzimidazol-2-yl]-[4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone;bis(4-methylbenzenesulfonic acid)
Molecular Formula	C46H51F3N6O8S2
Molecular Weight	937.1
Topological Polar Surface Area	203
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	15
Rotatable Bond Count	9
Heavy Atom Count	65
Formal Charge	0
Complexity	1110

SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CC1=CC=C(C=C1)S(=O)(=O)O.COC1=NC=C(C=C1)CN2CCC(CC2)C3=CC4=C(C=C3)N=C(N4)C(=O)N5CCN(CC5)CC6=CC=C(C=C6)C(F)(F)F

InChI

InChI=1S/C32H35F3N6O2.2C7H8O3S/c1-43-29-9-4-23(19-36-29)21-39-12-10-24(11-13-39)25-5-8-27-28(18-25)38-30(37-27)31(42)41-16-14-40(15-17-41)20-22-2-6-26(7-3-22)32(33,34)35;2*1-6-2-4-7(5-3-6)11(8,9)10/h2-9,18-19,24H,10-17,20-21H2,1H3,(H,37,38);2*2-5H,1H3,(H,8,9,10)

InChIKey

KDMGCEXVMOJAAC-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1640294-30-9

CID: 146673134

Formula: C46H51F3N6O8S2

MW: 937.1

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	937.1
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	15
Rotatable Bond Count	9
Exact Mass	936.31618944
Monoisotopic Mass	936.31618944
Topological Polar Surface Area	203 Å²
Heavy Atom Count	65
Formal Charge	0
Complexity	1110
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	3
Compound Is Canonicalized	Yes

Related Products

Catalog	Name
T14335-01	ASP6432
T71541-01	ASP9133

Alternative Products

Catalog	Name
BA4626-5	ASP4132
A22339-5	ASP4132 5mg
A22339-2	ASP4132 2mg
A22339-50	ASP4132 50mg
A22339-1	ASP4132 1mg
bs-7130C-01	ASP4132 tosylate
A22339-25	ASP4132 25mg
A22339-100	ASP4132 100mg
A22339-10	ASP4132 10mg

ASP4132

Chemical Information

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