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WWL70

CAT: 0931-T17260-06Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T17260-06Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
947669-91-2
Target
MAGL, Lipase
Related Pathways
Metabolism
Purity
0.9853
Bioactivity
WWL70 is a selective inhibitor of alpha/beta hydrolase domain 6 with an IC50 of 70 nM.
Smiles
CN(Cc1cccc(c1)-c1ccncc1)C(=O)Oc1ccc(cc1)-c1ccc(cc1)C(N)=O
Molecular Formula
C27H23N3O3
Molecular Weight
437.49
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Wwl70
CAS Number947669-91-2
PubChem CID17759121
IUPAC Name[4-(4-carbamoylphenyl)phenyl] N-methyl-N-[(3-pyridin-4-ylphenyl)methyl]carbamate
Molecular FormulaC27H23N3O3
Molecular Weight437.5
XLogP4.2
Topological Polar Surface Area85.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Heavy Atom Count33
Formal Charge0
Complexity635
SMILES
CN(CC1=CC(=CC=C1)C2=CC=NC=C2)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C(=O)N
InChI
InChI=1S/C27H23N3O3/c1-30(18-19-3-2-4-24(17-19)22-13-15-29-16-14-22)27(32)33-25-11-9-21(10-12-25)20-5-7-23(8-6-20)26(28)31/h2-17H,18H2,1H3,(H2,28,31)
InChIKey
QTWNORFUQILKJL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Wwl70
CAS: 947669-91-2
CID: 17759121
Formula: C27H23N3O3
MW: 437.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight437.5
XLogP34.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Exact Mass437.17394160
Monoisotopic Mass437.17394160
Topological Polar Surface Area85.5 Ų
Heavy Atom Count33
Formal Charge0
Complexity635
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

Alternative Products

CatalogName
MBS3612370-01WWL70
A15994-2WWL70 2mg
A15994-50WWL70 50mg
A15994-25WWL70 25mg
A15994-5WWL70 5mg
A15994-200WWL70 200mg
A15994-100WWL70 100mg
A15994-10WWL70 10mg
A15994-10mM-DWWL70 10mM * 1mL in DMSO

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