Products for Research Use Only
RegisterLogin

KML 29

CAT: 0607-B5745-100Size: 100 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0607-B5745-100Size:100 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
monoacylglycerol lipase (MAGL) inhibitor
CAS Number
1380424-42-9
Product Name Alternative
1,1,1,3,3,3-hexafluoropropan-2-yl 4-(bis(benzo[d][1,3]dioxol-5-yl)(hydroxy)methyl)piperidine-1-carboxylate
Field of Research
Neuroscience AChE
Purity
0.98
Form
A crystalline solid
Solubility
Soluble in DMSO
Smiles
FC(F)(F)C(OC(N1CCC(C(C2=CC3=C(OCO3)C=C2)(O)C4=CC5=C(OCO5)C=C4)CC1)=O)C(F)(F)F
Molecular Formula
C24H21F6NO7
Molecular Weight
549.42
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

1,1,1,3,3,3-Hexafluoropropan-2-yl 4-(bis(benzo(d)(1,3)dioxol-5-yl)(hydroxy)methyl)piperidine-1-carboxylate

inhibits monoacylglycerol lipase

CAS Number1380424-42-9
PubChem CID71656212
IUPAC Name1,1,1,3,3,3-hexafluoropropan-2-yl 4-[bis(1,3-benzodioxol-5-yl)-hydroxymethyl]piperidine-1-carboxylate
Molecular FormulaC24H21F6NO7
Molecular Weight549.4
XLogP5.1
Topological Polar Surface Area86.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count13
Rotatable Bond Count5
Heavy Atom Count38
Formal Charge0
Complexity803
SMILES
C1CN(CCC1C(C2=CC3=C(C=C2)OCO3)(C4=CC5=C(C=C4)OCO5)O)C(=O)OC(C(F)(F)F)C(F)(F)F
InChI
InChI=1S/C24H21F6NO7/c25-23(26,27)20(24(28,29)30)38-21(32)31-7-5-13(6-8-31)22(33,14-1-3-16-18(9-14)36-11-34-16)15-2-4-17-19(10-15)37-12-35-17/h1-4,9-10,13,20,33H,5-8,11-12H2
InChIKey
SXHQLPHDBLTFPM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,1,1,3,3,3-Hexafluoropropan-2-yl 4-(bis(benzo(d)(1,3)dioxol-5-yl)(hydroxy)methyl)piperidine-1-carboxylate
CAS: 1380424-42-9
CID: 71656212
Formula: C24H21F6NO7
MW: 549.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight549.4
XLogP35.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count13
Rotatable Bond Count5
Exact Mass549.12222098
Monoisotopic Mass549.12222098
Topological Polar Surface Area86.7 Ų
Heavy Atom Count38
Formal Charge0
Complexity803
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
BA3221-1ZX-29
BA3221-5ZX-29
BA8845-5BTK-IN-29
BA4511-10Et-29
B7668-50VU 29
BA1568-10SMAP-29
BA3221-10ZX-29
BA1888-50HCV-IN-29
BA4511-5Et-29
BA3221-25ZX-29

Alternative Products

CatalogName
C52001-100MGα-GalNAc-PEG3-Alkyne
A45280-100UGPIK3CG Antibody
A19927-100ULDTL Antibody
A36960-50UGTMEM59 Antibody
EK244621Rat PⅠNP (Procollagen Ⅰ N-Terminal Propeptide) ELISA Kit
EK251487Mouse MBL (Mannose Binding Lectin) ELISA Kit
A48930-100ULIGFBP4 Antibody
A12133-100ULAGPAT1 Antibody
A38810-50UGZNF227 Antibody
A15549-100UGTRAF3IP3 Antibody

Popular Products