Sornidipine

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Description

Sornidipine is a calcium channel blocker. Sornidipine also reduces neurogenic inflammation. Sornidipine reduces the inflow of calcium ions into cells by blocking L-type calcium channels, thereby reducing the contraction of vascular smooth muscle, leading to vasodilation and decreased blood pressure. Sornidipine can be used to study the cardiovascular system especially in hypertension and related cardiovascular diseases[1].

CAS Number

95105-77-4

UNSPSC

12352005

Target

Calcium Channel

Type

Reference compound

Related Pathways

Membrane Transporter/Ion Channel; Neuronal Signaling

Applications

COVID-19-immunoregulation

Field of Research

Inflammation/Immunology; Neurological Disease; Cardiovascular Disease

Assay Protocol

https://www.medchemexpress.com/sornidipine.html

Smiles

O[C@@H](CO1)[C@](OC2)([H])[C@@]1([H])[C@@H]2OC(C3=C(C)NC(C)=C(C(OC)=O)[C@H]3C4=C(C=CC=C4)[N+]([O-])=O)=O

Molecular Formula

C22H24N2O9

Molecular Weight

460.43

References & Citations

[1]Clifford J, et al. Permanently charged sodium and calcium channel blockers as anti-inflammatory agents.WO2011006073A1.2021-06-02

Shipping Conditions

Room temperature

Scientific Category

Reference compound1

Clinical Information

No Development Reported

Chemical Information

Sornidipine

Sornidipine is a small molecule drug. The usage of the INN stem '-dipine' in the name indicates that Sornidipine is a calcium channel blocker, nifedipine derivative. Sornidipine has a monoisotopic molecular weight of 460.15 Da.

CAS Number	95105-77-4
PubChem CID	76971303
IUPAC Name	5-O-[(3S,3aR,6R,6aR)-3-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] 3-O-methyl (4S)-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Molecular Formula	C22H24N2O9
Molecular Weight	460.4
XLogP	1
Topological Polar Surface Area	149
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	6
Heavy Atom Count	33
Formal Charge	0
Complexity	893

SMILES

CC1=C([C@@H](C(=C(N1)C)C(=O)O[C@@H]2CO[C@H]3[C@@H]2OC[C@@H]3O)C4=CC=CC=C4[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C22H24N2O9/c1-10-16(21(26)30-3)18(12-6-4-5-7-13(12)24(28)29)17(11(2)23-10)22(27)33-15-9-32-19-14(25)8-31-20(15)19/h4-7,14-15,18-20,23,25H,8-9H2,1-3H3/t14-,15+,18-,19+,20+/m0/s1

InChIKey

ODVDIRMTZXLSKT-OBNKQFAMSA-N

Chemical Structure

2D Structure

CAS: 95105-77-4

CID: 76971303

Formula: C22H24N2O9

MW: 460.4

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	460.4
XLogP3	1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	6
Exact Mass	460.14818035
Monoisotopic Mass	460.14818035
Topological Polar Surface Area	149 Å²
Heavy Atom Count	33
Formal Charge	0
Complexity	893
Isotope Atom Count	0
Defined Atom Stereocenter Count	5
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
T88044-01	Sornidipine

Sornidipine

Chemical Information

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