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TJ191

CAT: 0013-GTR19156067-03Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19156067-03Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
TJ191 is a selective anti-cancer agent, targeting low TβRIII-expressing malignant T-cell leukemia/lymphoma cells.
CAS Number
1522415-97-9
Purity
>98% (HPLC)
Solubility
DMSO:10 mM
Smiles
CCCCCCCC1=CC (C (OC) =O) =C (N) S1
Molecular Formula
C13H21NO2S
Molecular Weight
255.38
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Methyl 2-amino-5-heptylthiophene-3-carboxylate
CAS Number1522415-97-9
PubChem CID72704992
IUPAC Namemethyl 2-amino-5-heptylthiophene-3-carboxylate
Molecular FormulaC13H21NO2S
Molecular Weight255.38
XLogP5
Topological Polar Surface Area80.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Heavy Atom Count17
Formal Charge0
Complexity235
SMILES
CCCCCCCC1=CC(=C(S1)N)C(=O)OC
InChI
InChI=1S/C13H21NO2S/c1-3-4-5-6-7-8-10-9-11(12(14)17-10)13(15)16-2/h9H,3-8,14H2,1-2H3
InChIKey
HUFNXSPJUAHQHP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methyl 2-amino-5-heptylthiophene-3-carboxylate
CAS: 1522415-97-9
CID: 72704992
Formula: C13H21NO2S
MW: 255.38
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight255.38
XLogP35
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Exact Mass255.12930009
Monoisotopic Mass255.12930009
Topological Polar Surface Area80.6 Ų
Heavy Atom Count17
Formal Charge0
Complexity235
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
BA3308-10TJ191

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