Modipafant
TL;DR: Modipafant (CAS 122956-68-7) is a chemical compound with molecular formula C34H29ClN6O3 and molecular weight 604.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (4R)-4-(2-chlorophenyl)-6-methyl-2-[4-(2-methylimidazo[4,5-c]pyridin-1-yl)phenyl]-5-(pyridin-2-ylcarbamoyl)-1,4-dihydropyridine-3-carboxylate
Also Known As: Modipafant, modipafantum, rac-Modipafant, Modipafant [INN:BAN], MODIPAFANT [INN]
| Molecular Formula | C34H29ClN6O3 |
|---|---|
| Molecular Weight | 604.20 g/mol |
| LogP | 6.35122 |
| Topological Polar Surface Area | 111.03 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 604.199 |
| Heavy Atoms | 44 |
| Complexity | 1947.2731 |
Chemical Identifiers
| CAS Number | 122956-68-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=C([C@H]1C2=CC=CC=C2Cl)C(=O)NC3=CC=CC=N3)C)C4=CC=C(C=C4)N5C(=NC6=C5C=CN=C6)C |
Product Overview
Modipafant (CAS 122956-68-7), with molecular formula C34H29ClN6O3 and molecular weight 604.20 g/mol. IUPAC: ethyl (4R)-4-(2-chlorophenyl)-6-methyl-2-[4-(2-methylimidazo[4,5-c]pyridin-1-yl)phenyl]-5-(pyridin-2-ylcarbamoyl)-1,4-dihydropyridine-3-carboxylate.
Chemical Property Profile of Modipafant
Property Insights of Modipafant
The XLogP value of 6.35122 indicates that Modipafant is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.03 Ų falls within the moderate polarity range, balancing permeability and solubility for Modipafant. Following Lipinski's Rule of Five, Modipafant has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Modipafant?
The CAS number of Modipafant is 122956-68-7.
What is the molecular formula of Modipafant?
The molecular formula of Modipafant is C34H29ClN6O3.
What is the molecular weight of Modipafant?
The molecular weight of Modipafant is 604.20 g/mol.
Where can I buy Modipafant?
You can request a quote for Modipafant directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Modipafant?
Yes, KEHONG BIO provides custom synthesis services for Modipafant and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.