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SB 366791

CAT: 0607-B6804-5.1Size: 10 mM (in 1mL DMSO)Dry Ice: NoHazardous: No
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CAT#:0607-B6804-5.1Size:10 mM (in 1mL DMSO)
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Description
vanilloid TRPV1 receptor antagonist
CAS Number
472981-92-3
Product Name Alternative
(E)-3-(4-chlorophenyl)-N-(3-methoxyphenyl)acrylamide
Field of Research
Membrane Transporter Ion Channel TRP Channel
Purity
0.9866
Form
A solid
Solubility
insoluble in H2O; insoluble in EtOH; ≥12.35 mg/mL in DMSO
Smiles
ClC1=CC=C(C=C1)/C=C/C(NC2=CC=CC(OC)=C2)=O
Molecular Formula
C16H14ClNO2
Molecular Weight
287.75
Shipping Conditions
Room Temperature
Storage Conditions
Store at RT.

Chemical Information

SB-366791

3-(4-chlorophenyl)-N-(3-methoxyphenyl)-2-propenamide is a secondary carboxamide and a member of cinnamamides.

CAS Number472981-92-3
PubChem CID667594
IUPAC Name(E)-3-(4-chlorophenyl)-N-(3-methoxyphenyl)prop-2-enamide
Molecular FormulaC16H14ClNO2
Molecular Weight287.74
XLogP4.2
Topological Polar Surface Area38.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count20
Formal Charge0
Complexity337
SMILES
COC1=CC=CC(=C1)NC(=O)/C=C/C2=CC=C(C=C2)Cl
InChI
InChI=1S/C16H14ClNO2/c1-20-15-4-2-3-14(11-15)18-16(19)10-7-12-5-8-13(17)9-6-12/h2-11H,1H3,(H,18,19)/b10-7+
InChIKey
RYAMDQKWNKKFHD-JXMROGBWSA-N
Chemical Structure
2D Structure
2D structure of SB-366791
CAS: 472981-92-3
CID: 667594
Formula: C16H14ClNO2
MW: 287.74
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight287.74
XLogP34.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass287.0713064
Monoisotopic Mass287.0713064
Topological Polar Surface Area38.3 Ų
Heavy Atom Count20
Formal Charge0
Complexity337
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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