Nky 722
TL;DR: Nky 722 (CAS 136575-75-2) is a chemical compound with molecular formula C28H40Cl2N4O6 and molecular weight 598.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
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;dihydrochloride
Also Known As: Iganidipine HCl, Iganidipine hydrochloride, iganidipine dihydrochloride, Nky 722, KIRENIDIPINE HYDROCHLORIDE
| Molecular Formula | C28H40Cl2N4O6 |
|---|---|
| Molecular Weight | 598.23 g/mol |
| LogP | 4.2192 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 598.2325 |
| Heavy Atoms | 40 |
| Complexity | 974.0 |
Chemical Identifiers
| CAS Number | 136575-75-2 |
|---|---|
| SMILES | CC1=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.Cl.Cl |
| InChIKey | PJGTYHKZUAHNHC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Nky 722 (CAS 136575-75-2), with molecular formula C28H40Cl2N4O6 and molecular weight 598.23 g/mol. IUPAC: 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;dihydrochloride.
Chemical Property Profile of Nky 722
Property Insights of Nky 722
The XLogP value of 4.2192 indicates that Nky 722 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 Nky 722. Following Lipinski's Rule of Five, Nky 722 has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Nky 722?
The CAS number of Nky 722 is 136575-75-2.
What is the molecular formula of Nky 722?
The molecular formula of Nky 722 is C28H40Cl2N4O6.
What is the molecular weight of Nky 722?
The molecular weight of Nky 722 is 598.23 g/mol.
Where can I buy Nky 722?
You can request a quote for Nky 722 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nky 722?
Yes, KEHONG BIO provides custom synthesis services for Nky 722 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.