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AP-C1

CAT: 0931-T82992-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T82992-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2234280-26-1
Target
PKA, Others
Related Pathways
Others, Tyrosine Kinase/Adaptors
Bioactivity
AP-C1 is a potent inhibitor of cGMP-dependent protein kinase II (cGKII), exhibiting a pIC50 value of 6.5, but only weakly inhibits cGKII-dependent anion secretion [1].
Smiles
N=1C=CC(=NC1NCCC2=CC=C(OC)C(OC)=C2)C=3C=CC=4C=CC=CC4C3
Molecular Formula
C24H23N3O2
Molecular Weight
385.46
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N-[2-(3,4-dimethoxyphenyl)ethyl]-4-naphthalen-2-ylpyrimidin-2-amine
CAS Number2234280-26-1
PubChem CID169450560
IUPAC NameN-[2-(3,4-dimethoxyphenyl)ethyl]-4-naphthalen-2-ylpyrimidin-2-amine
Molecular FormulaC24H23N3O2
Molecular Weight385.5
XLogP5.3
Topological Polar Surface Area56.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count29
Formal Charge0
Complexity491
SMILES
COC1=C(C=C(C=C1)CCNC2=NC=CC(=N2)C3=CC4=CC=CC=C4C=C3)OC
InChI
InChI=1S/C24H23N3O2/c1-28-22-10-7-17(15-23(22)29-2)11-13-25-24-26-14-12-21(27-24)20-9-8-18-5-3-4-6-19(18)16-20/h3-10,12,14-16H,11,13H2,1-2H3,(H,25,26,27)
InChIKey
VTARENPLDQKGQS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-[2-(3,4-dimethoxyphenyl)ethyl]-4-naphthalen-2-ylpyrimidin-2-amine
CAS: 2234280-26-1
CID: 169450560
Formula: C24H23N3O2
MW: 385.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight385.5
XLogP35.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass385.17902698
Monoisotopic Mass385.17902698
Topological Polar Surface Area56.3 Ų
Heavy Atom Count29
Formal Charge0
Complexity491
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