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SAMT-247

CAT: 0931-T24756-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T24756-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
850715-59-2
Target
Others, HIV Protease
Related Pathways
Microbiology/Virology, Others, Proteases/Proteasome
Bioactivity
SAMT-247 is an HIV inhibitor that acts by modifying the nucleocapsid NCp7 region of Gag in infected cells and blocking Gag processing and reducing infectivity.
Smiles
C(NCCC(N)=O)(=O)C1=C(SC(C)=O)C=CC=C1
Molecular Formula
C12H14N2O3S
Molecular Weight
266.32
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N-[2-(Acetylthio)benzoyl]-beta-alaninamide
CAS Number850715-59-2
PubChem CID46897926
IUPAC NameS-[2-[(3-amino-3-oxopropyl)carbamoyl]phenyl] ethanethioate
Molecular FormulaC12H14N2O3S
Molecular Weight266.32
XLogP0.3
Topological Polar Surface Area115
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count18
Formal Charge0
Complexity333
SMILES
CC(=O)SC1=CC=CC=C1C(=O)NCCC(=O)N
InChI
InChI=1S/C12H14N2O3S/c1-8(15)18-10-5-3-2-4-9(10)12(17)14-7-6-11(13)16/h2-5H,6-7H2,1H3,(H2,13,16)(H,14,17)
InChIKey
UNACIIIRYSLSOD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-[2-(Acetylthio)benzoyl]-beta-alaninamide
CAS: 850715-59-2
CID: 46897926
Formula: C12H14N2O3S
MW: 266.32
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight266.32
XLogP30.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass266.07251349
Monoisotopic Mass266.07251349
Topological Polar Surface Area115 Ų
Heavy Atom Count18
Formal Charge0
Complexity333
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

Related Products

CatalogName
T70169-01UAWJ-247
T12051-01MIV-247
T19701-01L-694,247
T201298-01Antibacterial agent 247
T80218-01GAD65 (247-266) epitope TFA
TMPJ-01193-01CLM-9 Protein, Human, Recombinant (aa 19-247, His)
TMPY-05824-01Dengue virus (DENV) (type 3, strain Philippines/H87/1956) E/Envelope Protein (aa 247-675, His)
TMPY-06386-01SARS-CoV-2 Spike S1 Protein (G75V & T76I & R246N & 247 deletion & 253 deletion & L452Q & F490S & D614G, His)
TMPY-06406-01SARS-CoV-2 Spike S1+S2 Protein (G75V & T76I & R246N & 247, 253 deletion & L452Q & F490S & D614G & T859N, His)
TMPY-04689-01Dengue virus (DENV) (type 2, strain New Guinea C/PUO-218 hybrid) E/Envelope Protein (aa 247-675, His)

Alternative Products

CatalogName
M16179-01SAMT-247
HY-112583-01MIV-247
MBS5812711UAWJ-247
MBS1325204-01Recombinant Clarkia breweri Salicylate O-methyltransferase (SAMT)
532068L-694,247
RM-T140847-01Tenofovir Impurity 247
A20122-100MIV-247 100mg
HY-W999571CRBN ligand-247
RM-T060575-01Tofacitinib Impurity 247
A20122-50MIV-247 50mg

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