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(+/-)-Niguldipine structure
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(+/-)-Niguldipine

TL;DR: (+/-)-Niguldipine (CAS 102993-22-6) is a chemical compound with molecular formula C36H39N3O6 and molecular weight 609.2839 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

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

Also Known As: NIGULDIPINE, Dexniguldipine, Niguldipino, Niguldipinum, DL-Niguldipine

CAS Number
102993-22-6
Molecular Formula
C36H39N3O6
Molecular Weight
609.2839 g/mol
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Application Areas

Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (18 patents) Analytical Reagents (8 patents) Biotechnology (65 patents) Catalysts (8 patents) Heterocyclic Building Blocks (113 patents)

Technical Specifications

Molecular FormulaC36H39N3O6
Molecular Weight609.2839 g/mol
XLogP6.8
Topological Polar Surface Area (TPSA)114.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors8
Rotatable Bonds11
Exact Mass609.2839 Da
Heavy Atoms45
Complexity1100.0
SMILESCC1=C(C(C(=C(N1)C)C(=O)OCCCN2CCC(CC2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC(=CC=C5)[N+](=O)[O-])C(=O)OC
InChIKeySVJMLYUFVDMUHP-UHFFFAOYSA-N

Chemical Property Profile of (+/-)-Niguldipine

XLogP
6.8
TPSA (Topological Polar Surface Area)
114.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
8
Rotatable Bonds
11
Heavy Atoms
45
Complexity
1100.0
Exact Mass
609.2839
Monoisotopic Mass
609.2839
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 (+/-)-Niguldipine

The XLogP value of 6.8 indicates that (+/-)-Niguldipine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (+/-)-Niguldipine. Following Lipinski's Rule of Five, (+/-)-Niguldipine has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of (+/-)-Niguldipine?

The CAS number of (+/-)-Niguldipine is 102993-22-6.

What is the molecular formula of (+/-)-Niguldipine?

The molecular formula of (+/-)-Niguldipine is C36H39N3O6.

What is the molecular weight of (+/-)-Niguldipine?

The molecular weight of (+/-)-Niguldipine is 609.2839 g/mol.

Where can I buy (+/-)-Niguldipine?

You can request a quote for (+/-)-Niguldipine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for (+/-)-Niguldipine?

Yes, CoreyChem provides custom synthesis services for (+/-)-Niguldipine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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