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Iganidipine structure
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Iganidipine

TL;DR: Iganidipine (CAS 119687-33-1) is a chemical compound with molecular formula C28H38N4O6 and molecular weight 526.2791 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

5-O-[2,2-dimethyl-3-(4-prop-2-enylpiperazin-1-yl)propyl] 3-O-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Also Known As: Iganidipine, Kirenidipine, Iganidipino, iganidipinum, Iganidipine [INN]

CAS Number
119687-33-1
Molecular Formula
C28H38N4O6
Molecular Weight
526.2791 g/mol
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Application Areas

Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.

Analytical Reagents (3 patents) Heterocyclic Building Blocks (6 patents) Pharmaceutical Intermediates (22 patents)

Technical Specifications

Molecular FormulaC28H38N4O6
Molecular Weight526.2791 g/mol
XLogP4.2
Topological Polar Surface Area (TPSA)117.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors9
Rotatable Bonds11
Exact Mass526.2791 Da
Heavy Atoms38
Complexity974.0
SMILESCC1=C(C(C(=C(N1)C)C(=O)OCC(C)(C)CN2CCN(CC2)CC=C)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OC
InChIKeyQBTSPDQKRVMTRU-UHFFFAOYSA-N

Chemical Property Profile of Iganidipine

XLogP
4.2
TPSA (Topological Polar Surface Area)
117.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
9
Rotatable Bonds
11
Heavy Atoms
38
Complexity
974.0
Exact Mass
526.2791
Monoisotopic Mass
526.2791
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Iganidipine

The XLogP value of 4.2 indicates that Iganidipine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Iganidipine. Following Lipinski's Rule of Five, Iganidipine has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Iganidipine?

The CAS number of Iganidipine is 119687-33-1.

What is the molecular formula of Iganidipine?

The molecular formula of Iganidipine is C28H38N4O6.

What is the molecular weight of Iganidipine?

The molecular weight of Iganidipine is 526.2791 g/mol.

Where can I buy Iganidipine?

You can request a quote for Iganidipine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Iganidipine?

Yes, CoreyChem provides custom synthesis services for Iganidipine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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