2-amino-6-[(3,4-dichlorobenzyl)sulfanyl]-4-(3,4,5-trimethoxyphenyl)-3,5-pyridinedicarbonitrile
TL;DR: 2-amino-6-[(3,4-dichlorobenzyl)sulfanyl]-4-(3,4,5-trimethoxyphenyl)-3,5-pyridinedicarbonitrile (CAS 354554-48-6) is a chemical compound with molecular formula C23H18Cl2N4O3S and molecular weight 500.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-6-[(3,4-dichlorophenyl)methylsulfanyl]-4-(3,4,5-trimethoxyphenyl)pyridine-3,5-dicarbonitrile
Also Known As: 2-amino-6-[(3,4-dichlorobenzyl)sulfanyl]-4-(3,4,5-trimethoxyphenyl)-3,5-pyridinedicarbonitrile, AM-807/13103083, 2-amino-6-[(3,4-dichlorophenyl)methylsulfanyl]-4-(3,4,5-trimethoxyphenyl)pyridine-3,5-dicarbonitrile, 2-amino-6-((3,4-dichlorobenzyl)thio)-4-(3,4,5-trimethoxyphenyl)pyridine-3,5-dicarbonitrile, 2-amino-6-[(3,4-dichlorobenzyl)sulfanyl]-4-(3,4,5-trimethoxyphenyl)pyridine-3,5-dicarbonitrile
| Molecular Formula | C23H18Cl2N4O3S |
|---|---|
| Molecular Weight | 500.05 g/mol |
| LogP | 5.69906 |
| Topological Polar Surface Area | 114.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 500.04767 |
| Heavy Atoms | 33 |
| Complexity | 1277.325 |
Chemical Identifiers
| CAS Number | 354554-48-6 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C2=C(C(=NC(=C2C#N)SCC3=CC(=C(C=C3)Cl)Cl)N)C#N |
Product Overview
2-amino-6-[(3,4-dichlorobenzyl)sulfanyl]-4-(3,4,5-trimethoxyphenyl)-3,5-pyridinedicarbonitrile (CAS 354554-48-6), with molecular formula C23H18Cl2N4O3S and molecular weight 500.05 g/mol. IUPAC: 2-amino-6-[(3,4-dichlorophenyl)methylsulfanyl]-4-(3,4,5-trimethoxyphenyl)pyridine-3,5-dicarbonitrile.
Chemical Property Profile of 2-amino-6-[(3,4-dichlorobenzyl)sulfanyl]-4-(3,4,5-trimethoxyphenyl)-3,5-pyridinedicarbonitrile
Property Insights of 2-amino-6-[(3,4-dichlorobenzyl)sulfanyl]-4-(3,4,5-trimethoxyphenyl)-3,5-pyridinedicarbonitrile
The XLogP value of 5.69906 indicates that 2-amino-6-[(3,4-dichlorobenzyl)sulfanyl]-4-(3,4,5-trimethoxyphenyl)-3,5-pyridinedicarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.18 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-amino-6-[(3,4-dichlorobenzyl)sulfanyl]-4-(3,4,5-trimethoxyphenyl)-3,5-pyridinedicarbonitrile. Following Lipinski's Rule of Five, 2-amino-6-[(3,4-dichlorobenzyl)sulfanyl]-4-(3,4,5-trimethoxyphenyl)-3,5-pyridinedicarbonitrile has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-amino-6-[(3,4-dichlorobenzyl)sulfanyl]-4-(3,4,5-trimethoxyphenyl)-3,5-pyridinedicarbonitrile?
The CAS number of 2-amino-6-[(3,4-dichlorobenzyl)sulfanyl]-4-(3,4,5-trimethoxyphenyl)-3,5-pyridinedicarbonitrile is 354554-48-6.
What is the molecular formula of 2-amino-6-[(3,4-dichlorobenzyl)sulfanyl]-4-(3,4,5-trimethoxyphenyl)-3,5-pyridinedicarbonitrile?
The molecular formula of 2-amino-6-[(3,4-dichlorobenzyl)sulfanyl]-4-(3,4,5-trimethoxyphenyl)-3,5-pyridinedicarbonitrile is C23H18Cl2N4O3S.
What is the molecular weight of 2-amino-6-[(3,4-dichlorobenzyl)sulfanyl]-4-(3,4,5-trimethoxyphenyl)-3,5-pyridinedicarbonitrile?
The molecular weight of 2-amino-6-[(3,4-dichlorobenzyl)sulfanyl]-4-(3,4,5-trimethoxyphenyl)-3,5-pyridinedicarbonitrile is 500.05 g/mol.
Where can I buy 2-amino-6-[(3,4-dichlorobenzyl)sulfanyl]-4-(3,4,5-trimethoxyphenyl)-3,5-pyridinedicarbonitrile?
You can request a quote for 2-amino-6-[(3,4-dichlorobenzyl)sulfanyl]-4-(3,4,5-trimethoxyphenyl)-3,5-pyridinedicarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-amino-6-[(3,4-dichlorobenzyl)sulfanyl]-4-(3,4,5-trimethoxyphenyl)-3,5-pyridinedicarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-amino-6-[(3,4-dichlorobenzyl)sulfanyl]-4-(3,4,5-trimethoxyphenyl)-3,5-pyridinedicarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.