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Acetobixan

CAT: 0931-T23612-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T23612-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
380201-24-1
Target
Others
Related Pathways
Others
Bioactivity
Acetobixan is a cellulose synthesis inhibitor.
Smiles
COC1=C(CNC(=O)CSC2=CC=CC=C2)C=CC=C1
Molecular Formula
C16H17NO2S
Molecular Weight
287.38
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N-(2-methoxybenzyl)-2-(phenylthio)acetamide

inhibits cellulose biosynthesis

CAS Number380201-24-1
PubChem CID881386
IUPAC NameN-[(2-methoxyphenyl)methyl]-2-phenylsulfanylacetamide
Molecular FormulaC16H17NO2S
Molecular Weight287.4
XLogP3.2
Topological Polar Surface Area63.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Heavy Atom Count20
Formal Charge0
Complexity292
SMILES
COC1=CC=CC=C1CNC(=O)CSC2=CC=CC=C2
InChI
InChI=1S/C16H17NO2S/c1-19-15-10-6-5-7-13(15)11-17-16(18)12-20-14-8-3-2-4-9-14/h2-10H,11-12H2,1H3,(H,17,18)
InChIKey
IVFWWYCRJNLKNB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(2-methoxybenzyl)-2-(phenylthio)acetamide
CAS: 380201-24-1
CID: 881386
Formula: C16H17NO2S
MW: 287.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight287.4
XLogP33.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass287.09799996
Monoisotopic Mass287.09799996
Topological Polar Surface Area63.6 Ų
Heavy Atom Count20
Formal Charge0
Complexity292
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
GTR19200615-01Acetobixan

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