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UK51656

CAT: 0931-T13250-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T13250-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
88150-59-8
Target
Calcium Channel
Related Pathways
Membrane transporter/Ion channel, Metabolism
Bioactivity
UK51656 is an antagonist of calcium (IC50: 4 nM) .
Smiles
C(OCC)(=O)C=1C(C(C(OC)=O)=C(C)NC1COCCNCC(N)=O)C2=C(Cl)C=CC=C2
Molecular Formula
C22H28ClN3O6
Molecular Weight
465.93
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

3-O-ethyl 5-O-methyl 2-[2-[(2-amino-2-oxoethyl)amino]ethoxymethyl]-4-(2-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate
CAS Number88150-59-8
PubChem CID9912345
IUPAC Name3-O-ethyl 5-O-methyl 2-[2-[(2-amino-2-oxoethyl)amino]ethoxymethyl]-4-(2-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate
Molecular FormulaC22H28ClN3O6
Molecular Weight465.9
XLogP2.5
Topological Polar Surface Area129
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count13
Heavy Atom Count32
Formal Charge0
Complexity767
SMILES
CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C(=O)OC)C)COCCNCC(=O)N
InChI
InChI=1S/C22H28ClN3O6/c1-4-32-22(29)20-16(12-31-10-9-25-11-17(24)27)26-13(2)18(21(28)30-3)19(20)14-7-5-6-8-15(14)23/h5-8,19,25-26H,4,9-12H2,1-3H3,(H2,24,27)
InChIKey
FAKQIHAUXYAVJI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-O-ethyl 5-O-methyl 2-[2-[(2-amino-2-oxoethyl)amino]ethoxymethyl]-4-(2-chlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate
CAS: 88150-59-8
CID: 9912345
Formula: C22H28ClN3O6
MW: 465.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight465.9
XLogP32.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count13
Exact Mass465.1666633
Monoisotopic Mass465.1666633
Topological Polar Surface Area129 Ų
Heavy Atom Count32
Formal Charge0
Complexity767
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-101707UK51656
A19736-50UK51656 50mg
A19736-100UK51656 100mg
A19736-10UK51656 10mg
A19736-5UK51656 5mg
A19736-25UK51656 25mg
A19736-1UK51656 1mg

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