Products for Research Use Only
RegisterLogin

OPC 13463

CAT: 0013-GTR19223007-02Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19223007-02Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
OPC 13463 is the primary active metabolite of the calcium channel blocker pranidipine. It is utilized in pharmacological research to study the metabolism, pharmacokinetics, and in vivo cardiovascular effects of dihydropyridine drugs.
CAS Number
73372-63-1
Smiles
O=[N+] (C1=C (C=CC=C1) C2=C (C (OC) =O) C (C) =NC (C) =C2C (O) =O) [O-]
Molecular Formula
C16H14N2O6
Molecular Weight
330.29
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

3-Methyl 2,6-dimethyl-4-(2-nitrophenyl)-3,5-pyridinedicarboxylate

metabolite of pranidipine; structure in first source

CAS Number73372-63-1
PubChem CID175469
IUPAC Name5-methoxycarbonyl-2,6-dimethyl-4-(2-nitrophenyl)pyridine-3-carboxylic acid
Molecular FormulaC16H14N2O6
Molecular Weight330.29
XLogP2.5
Topological Polar Surface Area122
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Heavy Atom Count24
Formal Charge0
Complexity505
SMILES
CC1=C(C(=C(C(=N1)C)C(=O)OC)C2=CC=CC=C2[N+](=O)[O-])C(=O)O
InChI
InChI=1S/C16H14N2O6/c1-8-12(15(19)20)14(13(9(2)17-8)16(21)24-3)10-6-4-5-7-11(10)18(22)23/h4-7H,1-3H3,(H,19,20)
InChIKey
LCCVJQVUSQPANR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Methyl 2,6-dimethyl-4-(2-nitrophenyl)-3,5-pyridinedicarboxylate
CAS: 73372-63-1
CID: 175469
Formula: C16H14N2O6
MW: 330.29
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight330.29
XLogP32.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Exact Mass330.08518617
Monoisotopic Mass330.08518617
Topological Polar Surface Area122 Ų
Heavy Atom Count24
Formal Charge0
Complexity505
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
GTR19190380-01OPC-167832
GTR19160669-01OPC 21268
GTR19204259-01OPC-28326
GTR19219513-01OPC-163493
GTR19209239-01Opc 4392
GTR19196858-01OPC-51803
GTR19223006-01OPC 18692
GTR19211218-01Opc 3911
GTR19208159-01Opc 15161
GTR19193243-01Opc 18750

Alternative Products

CatalogName
T33804-01OPC 13463

Popular Products