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MCP110

CAT: 0931-T24437-07Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T24437-07Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
521310-51-0
Target
Raf, Ras
Related Pathways
MAPK, GPCR/G Protein
Purity
0.9723
Bioactivity
MCP110 is an inhibitor of the interaction of Ras with Raf-1 and can be used in studies about the treatment of human tumors.
Smiles
COc1cc(CN(CCc2ccccn2)C(=O)CCCCc2ccccc2)ccc1OCc1ccccc1
Molecular Formula
C33H36N2O3
Molecular Weight
508.65
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N-(4-(benzyloxy)-3-methoxybenzyl)-5-phenyl-N-(2-(pyridin-2-yl)ethyl)pentanamide
CAS Number521310-51-0
PubChem CID10229237
IUPAC NameN-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-5-phenyl-N-(2-pyridin-2-ylethyl)pentanamide
Molecular FormulaC33H36N2O3
Molecular Weight508.6
XLogP6.4
Topological Polar Surface Area51.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count14
Heavy Atom Count38
Formal Charge0
Complexity646
SMILES
COC1=C(C=CC(=C1)CN(CCC2=CC=CC=N2)C(=O)CCCCC3=CC=CC=C3)OCC4=CC=CC=C4
InChI
InChI=1S/C33H36N2O3/c1-37-32-24-29(19-20-31(32)38-26-28-15-6-3-7-16-28)25-35(23-21-30-17-10-11-22-34-30)33(36)18-9-8-14-27-12-4-2-5-13-27/h2-7,10-13,15-17,19-20,22,24H,8-9,14,18,21,23,25-26H2,1H3
InChIKey
JWLZIHLAMJDONF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(4-(benzyloxy)-3-methoxybenzyl)-5-phenyl-N-(2-(pyridin-2-yl)ethyl)pentanamide
CAS: 521310-51-0
CID: 10229237
Formula: C33H36N2O3
MW: 508.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight508.6
XLogP36.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count14
Exact Mass508.27259301
Monoisotopic Mass508.27259301
Topological Polar Surface Area51.7 Ų
Heavy Atom Count38
Formal Charge0
Complexity646
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
TMPH-03328-01Mcpt1 Protein, Rat, Recombinant (Myc)

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