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Autogramin-2

CAT: 0013-GTR19155818-01Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19155818-01Size:200 mg
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Description
Autogramin-2 potently inhibits autophagy induced by either starvation with IC50 of 0.27 μM, and inhibits mTORC1 (Rapamycin; IC50:0.14 μM)
CAS Number
2375541-45-8
Product Name Alternative
Tert-butyl 2- (4-isopropoxybenzamido) -6,7-dihydrothiazolo[5,4-c]pyridine-5 (4H) -carboxylate
Purity
>98% (HPLC)
Solubility
DMSO:83.33 mg/mL (199.58 mM; Need ultrasonic)
Smiles
O=C (N1CCC2=C (SC (NC (C3=CC=C (OC (C) C) C=C3) =O) =N2) C1) OC (C) (C) C
Molecular Formula
C21H27N3O4S
Molecular Weight
417.52
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Autogramin-2
CAS Number2375541-45-8
PubChem CID36765911
IUPAC Nametert-butyl 2-[(4-propan-2-yloxybenzoyl)amino]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-5-carboxylate
Molecular FormulaC21H27N3O4S
Molecular Weight417.5
XLogP3.7
Topological Polar Surface Area109
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Heavy Atom Count29
Formal Charge0
Complexity587
SMILES
CC(C)OC1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)CN(CC3)C(=O)OC(C)(C)C
InChI
InChI=1S/C21H27N3O4S/c1-13(2)27-15-8-6-14(7-9-15)18(25)23-19-22-16-10-11-24(12-17(16)29-19)20(26)28-21(3,4)5/h6-9,13H,10-12H2,1-5H3,(H,22,23,25)
InChIKey
PNSFNXURLSDVRV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Autogramin-2
CAS: 2375541-45-8
CID: 36765911
Formula: C21H27N3O4S
MW: 417.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight417.5
XLogP33.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Exact Mass417.17222752
Monoisotopic Mass417.17222752
Topological Polar Surface Area109 Ų
Heavy Atom Count29
Formal Charge0
Complexity587
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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