Nisoldipine (m4)
TL;DR: Nisoldipine (m4) (CAS 117191-84-1) is a chemical compound with molecular formula C19H20N2O7 and molecular weight 388.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-hydroxy-2-methylpropoxy)carbonyl-2,6-dimethyl-4-(2-nitrophenyl)pyridine-3-carboxylic acid
Also Known As: Nisoldipine (m4), BAY-s-4755, 5-((2-Hydroxy-2-methylpropoxy)carbonyl)-2,6-dimethyl-4-(2-nitrophenyl)nicotinic acid, 3,5-Pyridinedicarboxylic acid, 2,6-dimethyl-4-(2-nitrophenyl)-, 3-(2-hydroxy-2-methylpropyl) ester, 2,6-Dimethyl-4-(2-nitrophenyl)pyridine-3,5-dicarboxylic acid 3-(2-hydroxy-2-methylpropyl) ester
| Molecular Formula | C19H20N2O7 |
|---|---|
| Molecular Weight | 388.13 g/mol |
| LogP | 2.89954 |
| Topological Polar Surface Area | 139.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 388.12704 |
| Heavy Atoms | 28 |
| Complexity | 961.485 |
Chemical Identifiers
| CAS Number | 117191-84-1 |
|---|---|
| SMILES | CC1=C(C(=C(C(=N1)C)C(=O)OCC(C)(C)O)C2=CC=CC=C2[N+](=O)[O-])C(=O)O |
Product Overview
Nisoldipine (m4) (CAS 117191-84-1), with molecular formula C19H20N2O7 and molecular weight 388.13 g/mol. IUPAC: 5-(2-hydroxy-2-methylpropoxy)carbonyl-2,6-dimethyl-4-(2-nitrophenyl)pyridine-3-carboxylic acid.
Chemical Property Profile of Nisoldipine (m4)
Property Insights of Nisoldipine (m4)
The XLogP value of 2.89954 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nisoldipine (m4). The TPSA of 139.86 Ų falls within the moderate polarity range, balancing permeability and solubility for Nisoldipine (m4). Following Lipinski's Rule of Five, Nisoldipine (m4) has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Nisoldipine (m4)?
The CAS number of Nisoldipine (m4) is 117191-84-1.
What is the molecular formula of Nisoldipine (m4)?
The molecular formula of Nisoldipine (m4) is C19H20N2O7.
What is the molecular weight of Nisoldipine (m4)?
The molecular weight of Nisoldipine (m4) is 388.13 g/mol.
Where can I buy Nisoldipine (m4)?
You can request a quote for Nisoldipine (m4) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nisoldipine (m4)?
Yes, KEHONG BIO provides custom synthesis services for Nisoldipine (m4) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.