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P-2281

CAT: 0013-GTR19196831-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19196831-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
P-2281
CAS Number
1112994-35-0
Product Name Alternative
MTOR, P2281, P-2281, P 2281
Field of Research
Signal Transduction
Purity
99.95% (May vary between batches)
Solubility
DMSO:50 mg/mL (238.52 mM)
Smiles
N (C (C (C) Cl) =O) C=1C=CC (C#N) =NC1
Molecular Formula
C9H8ClN3O
Molecular Weight
209.63
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-chloro-N-(6-cyanopyridin-3-yl)propanamide

an mTOR inhibitor; structure in first source

CAS Number1112994-35-0
PubChem CID25141337
IUPAC Name2-chloro-N-(6-cyano-3-pyridinyl)propanamide
Molecular FormulaC9H8ClN3O
Molecular Weight209.63
XLogP1.1
Topological Polar Surface Area65.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count14
Formal Charge0
Complexity260
SMILES
CC(C(=O)NC1=CN=C(C=C1)C#N)Cl
InChI
InChI=1S/C9H8ClN3O/c1-6(10)9(14)13-8-3-2-7(4-11)12-5-8/h2-3,5-6H,1H3,(H,13,14)
InChIKey
VFOLQYOVUCHHET-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-chloro-N-(6-cyanopyridin-3-yl)propanamide
CAS: 1112994-35-0
CID: 25141337
Formula: C9H8ClN3O
MW: 209.63
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight209.63
XLogP31.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass209.0355896
Monoisotopic Mass209.0355896
Topological Polar Surface Area65.8 Ų
Heavy Atom Count14
Formal Charge0
Complexity260
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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