尼莫地平
TL;DR: 尼莫地平 (CAS 66085-59-4) is a chemical compound with molecular formula C21H26N2O7 and molecular weight 418.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
尼莫地平
3-O-(2-methoxyethyl) 5-O-propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Also Known As: nimodipine, Nimotop, Periplum, Admon, Nimodipino
| Molecular Formula | C21H26N2O7 |
|---|---|
| Molecular Weight | 418.17 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 418.174 |
| Heavy Atoms | 30 |
| Complexity | 736.0 |
| Melting Point | 125 |
| Solubility | 1.20e-02 g/L |
Chemical Identifiers
| CAS Number | 66085-59-4 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)C)C(=O)OC(C)C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCCOC |
| InChIKey | UIAGMCDKSXEBJQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
尼莫地平 (CAS 66085-59-4), with molecular formula C21H26N2O7 and molecular weight 418.17 g/mol. IUPAC: 3-O-(2-methoxyethyl) 5-O-propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate.
Chemical Property Profile of 尼莫地平
Property Insights of 尼莫地平
The XLogP value of 3.1 indicates that 尼莫地平 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 尼莫地平. Following Lipinski's Rule of Five, 尼莫地平 has 1 hydrogen bond donor(s) and 8 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 尼莫地平?
The CAS number of 尼莫地平 is 66085-59-4.
What is the molecular formula of 尼莫地平?
The molecular formula of 尼莫地平 is C21H26N2O7.
What is the molecular weight of 尼莫地平?
The molecular weight of 尼莫地平 is 418.17 g/mol.
Where can I buy 尼莫地平?
You can request a quote for 尼莫地平 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 尼莫地平?
Yes, KEHONG BIO provides custom synthesis services for 尼莫地平 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.