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PD 198306

CAT: 0931-T21980-07Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T21980-07Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
212631-61-3
Target
MEK
Related Pathways
MAPK
Purity
0.9975
Bioactivity
PD 198306 is a selective inhibitor of MAPK/ERK-kinase (MEK) with antihyperalgesic effects. PD 198306 reduces the Streptozocin-induced increase in the level of active ERK1.
Smiles
N(C1=C(C(NOCC2CC2)=O)C=C(F)C(F)=C1F)C3=C(C)C=C(I)C=C3
Molecular Formula
C18H16F3IN2O2
Molecular Weight
476.23
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

PD 198306

N-(cyclopropylmethoxy)-3,4,5-trifluoro-2-(4-iodo-2-methylanilino)benzamide is an aminobenzoic acid.

CAS Number212631-61-3
PubChem CID9956637
IUPAC NameN-(cyclopropylmethoxy)-3,4,5-trifluoro-2-(4-iodo-2-methylanilino)benzamide
Molecular FormulaC18H16F3IN2O2
Molecular Weight476.2
XLogP5.4
Topological Polar Surface Area50.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Heavy Atom Count26
Formal Charge0
Complexity497
SMILES
CC1=C(C=CC(=C1)I)NC2=C(C(=C(C=C2C(=O)NOCC3CC3)F)F)F
InChI
InChI=1S/C18H16F3IN2O2/c1-9-6-11(22)4-5-14(9)23-17-12(7-13(19)15(20)16(17)21)18(25)24-26-8-10-2-3-10/h4-7,10,23H,2-3,8H2,1H3,(H,24,25)
InChIKey
UHAXDAKQGVISBZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of PD 198306
CAS: 212631-61-3
CID: 9956637
Formula: C18H16F3IN2O2
MW: 476.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight476.2
XLogP35.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Exact Mass476.02086
Monoisotopic Mass476.02086
Topological Polar Surface Area50.4 Ų
Heavy Atom Count26
Formal Charge0
Complexity497
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

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Alternative Products

CatalogName
525904PD-198306
256191PD 198306
A16032-10PD 198306 10mg
A16032-1PD 198306 1mg
A16032-100PD 198306 100mg
A16032-500PD 198306 500mg
A16032-50PD 198306 50mg
A16032-25PD 198306 25mg
A16032-5PD 198306 5mg
A16032-10mM-DPD 198306 10mM * 1mL in DMSO

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