ML-226

CAT: 0931-T8994-03Size: 1 mL - 10 mM (in DMSO)Dry Ice: NoHazardous: No

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CAT#:0931-T8994-03Size:1 mL - 10 mM (in DMSO)

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

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CAS Number

2055172-43-3

Target

MAGL

Related Pathways

Metabolism

Purity

0.9961

Bioactivity

ML226 is a α/β hydrolase domain-containing protein 11 (ABHD11) inhibitor that inhibits ABHD11 in vitro and in situ.

Smiles

C(O)(C1=NN(C(=O)N2C(CC)CCCC2)N=C1)(C3=CC=CC=C3)C4=CC=CC=C4

Molecular Formula

C23H26N4O2

Molecular Weight

390.48

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

(2-Ethylpiperidin-1-yl)-[4-[hydroxy(diphenyl)methyl]triazol-2-yl]methanone

CAS Number	2055172-43-3
PubChem CID	56593112
IUPAC Name	(2-ethylpiperidin-1-yl)-[4-[hydroxy(diphenyl)methyl]triazol-2-yl]methanone
Molecular Formula	C23H26N4O2
Molecular Weight	390.5
XLogP	4.3
Topological Polar Surface Area	71.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Heavy Atom Count	29
Formal Charge	0
Complexity	527

SMILES

CCC1CCCCN1C(=O)N2N=CC(=N2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O

InChI

InChI=1S/C23H26N4O2/c1-2-20-15-9-10-16-26(20)22(28)27-24-17-21(25-27)23(29,18-11-5-3-6-12-18)19-13-7-4-8-14-19/h3-8,11-14,17,20,29H,2,9-10,15-16H2,1H3

InChIKey

DGRUIUDIVFCWMX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2055172-43-3

CID: 56593112

Formula: C23H26N4O2

MW: 390.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	390.5
XLogP3	4.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	390.20557608
Monoisotopic Mass	390.20557608
Topological Polar Surface Area	71.3 Å²
Heavy Atom Count	29
Formal Charge	0
Complexity	527
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

Related Products

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T26465-01	A1-226
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T1918-01	NVP-TAE 226
TMAC-02536-01	Anti-Phospho-MAP2K1/MEK2 (Ser222/226) Polyclonal Antibody
TMPY-07228-01	2B4/CD244 Protein, Mouse, Recombinant (aa 1-226, His)
T22990	ML-090
T22999-01	ML-243
T22998-01	ML-233

Alternative Products

Catalog	Name
GTR19166945-01	ML-226
BA7964-1	ML-226
BUP01225-01	ML-?226
TRC-B367500-50MG	BGT 226
7762/10	EED 226
bs-82749C-01	KY-226
BITP1258	RHuCD4 226
B1845-5	EED-226
9436-5	TAE-226
GTR19198387-01	A1-226

ML-​226

Chemical Information

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ML-226