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AT-308

CAT: 0931-T30187-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T30187-01Size:25 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
40915-84-2
Target
Others
Related Pathways
Others
Bioactivity
AT-308 is a bio-active chemical.
Smiles
O=C(OCC)C(OC=1C=CC(=CC1)C2=NOC(=N2)C=3C=NC=CC3)(C)C
Molecular Formula
C19H19N3O4
Molecular Weight
353.37
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

AT-308

structure

CAS Number40915-84-2
PubChem CID191040
IUPAC Nameethyl 2-methyl-2-[4-(5-pyridin-3-yl-1,2,4-oxadiazol-3-yl)phenoxy]propanoate
Molecular FormulaC19H19N3O4
Molecular Weight353.4
XLogP3.2
Topological Polar Surface Area87.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Heavy Atom Count26
Formal Charge0
Complexity466
SMILES
CCOC(=O)C(C)(C)OC1=CC=C(C=C1)C2=NOC(=N2)C3=CN=CC=C3
InChI
InChI=1S/C19H19N3O4/c1-4-24-18(23)19(2,3)25-15-9-7-13(8-10-15)16-21-17(26-22-16)14-6-5-11-20-12-14/h5-12H,4H2,1-3H3
InChIKey
KQUZJAMAMASQDO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of AT-308
CAS: 40915-84-2
CID: 191040
Formula: C19H19N3O4
MW: 353.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight353.4
XLogP33.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Exact Mass353.13755610
Monoisotopic Mass353.13755610
Topological Polar Surface Area87.3 Ų
Heavy Atom Count26
Formal Charge0
Complexity466
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

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