9L-719
TL;DR: 9L-719 (CAS 478261-86-8) is a chemical compound with molecular formula C22H17Cl2F3N2O3S and molecular weight 516.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-chlorophenyl)-6-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl]-5-formyl-2-methyl-1,4-dihydropyridine-3-carboxylate
Also Known As: 9L-719, ethyl 4-(4-chlorophenyl)-6-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-5-formyl-2-methyl-1,4-dihydro-3-pyridinecarboxylate, ethyl 4-(4-chlorophenyl)-6-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-5-formyl-2-methyl-1,4-dihydropyridine-3-carboxylate, ethyl 6-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl}-4-(4-chlorophenyl)-5-formyl-2-methyl-1,4-dihydropyridine-3-carboxylate, ethyl6-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl}-4-(4-chlorophenyl)-5-formyl-2-methyl-1,4-dihydropyridine-3-carboxylate
| Molecular Formula | C22H17Cl2F3N2O3S |
|---|---|
| Molecular Weight | 516.03 g/mol |
| LogP | 6.1339 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 516.02893 |
| Heavy Atoms | 33 |
| Complexity | 1148.5653 |
Chemical Identifiers
| CAS Number | 478261-86-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=C(C1C2=CC=C(C=C2)Cl)C=O)SC3=C(C=C(C=N3)C(F)(F)F)Cl)C |
Product Overview
9L-719 (CAS 478261-86-8), with molecular formula C22H17Cl2F3N2O3S and molecular weight 516.03 g/mol. IUPAC: ethyl 4-(4-chlorophenyl)-6-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl]-5-formyl-2-methyl-1,4-dihydropyridine-3-carboxylate.
Chemical Property Profile of 9L-719
Property Insights of 9L-719
The XLogP value of 6.1339 indicates that 9L-719 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 9L-719. Following Lipinski's Rule of Five, 9L-719 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9L-719?
The CAS number of 9L-719 is 478261-86-8.
What is the molecular formula of 9L-719?
The molecular formula of 9L-719 is C22H17Cl2F3N2O3S.
What is the molecular weight of 9L-719?
The molecular weight of 9L-719 is 516.03 g/mol.
Where can I buy 9L-719?
You can request a quote for 9L-719 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9L-719?
Yes, KEHONG BIO provides custom synthesis services for 9L-719 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.