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ARN726

CAT: 0931-T60456-04Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T60456-04Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1628343-77-0
Target
Others
Related Pathways
Others
Bioactivity
ARN726 is a potent inhibitor of NAAA (N-acylethanolamine acid amidase) with an IC 50 of 0.073 μM which decreases the motivation for alcohol in a dose-dependent manner [1] [2].
Smiles
N(C(OCCCCC1CCCCC1)=O)[C@@H]2C(=O)NC2
Molecular Formula
C14H24N2O3
Molecular Weight
268.35
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

4-cyclohexylbutyl N-[(3S)-2-oxoazetidin-3-yl]carbamate
CAS Number1628343-77-0
PubChem CID78319072
IUPAC Name4-cyclohexylbutyl N-[(3S)-2-oxoazetidin-3-yl]carbamate
Molecular FormulaC14H24N2O3
Molecular Weight268.35
XLogP3.1
Topological Polar Surface Area67.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Heavy Atom Count19
Formal Charge0
Complexity314
SMILES
C1CCC(CC1)CCCCOC(=O)N[C@H]2CNC2=O
InChI
InChI=1S/C14H24N2O3/c17-13-12(10-15-13)16-14(18)19-9-5-4-8-11-6-2-1-3-7-11/h11-12H,1-10H2,(H,15,17)(H,16,18)/t12-/m0/s1
InChIKey
FNLUJRBWJBUJTC-LBPRGKRZSA-N
Chemical Structure
2D Structure
2D structure of 4-cyclohexylbutyl N-[(3S)-2-oxoazetidin-3-yl]carbamate
CAS: 1628343-77-0
CID: 78319072
Formula: C14H24N2O3
MW: 268.35
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight268.35
XLogP33.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Exact Mass268.17869263
Monoisotopic Mass268.17869263
Topological Polar Surface Area67.4 Ų
Heavy Atom Count19
Formal Charge0
Complexity314
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
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