![6-((3,4-dichlorobenzyl)thio)-3,3-dimethyl-8-morpholino-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile structure](/static/products/847/847377-91-7.png)
6-((3,4-dichlorobenzyl)thio)-3,3-dimethyl-8-morpholino-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile
TL;DR: 6-((3,4-dichlorobenzyl)thio)-3,3-dimethyl-8-morpholino-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile (CAS 847377-91-7) is a chemical compound with molecular formula C22H23Cl2N3OS2 and molecular weight 479.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(3,4-dichlorophenyl)methylsulfanyl]-3,3-dimethyl-8-morpholin-4-yl-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile
Also Known As: 6-((3,4-dichlorobenzyl)thio)-3,3-dimethyl-8-morpholino-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile, 6-[(3,4-dichlorobenzyl)sulfanyl]-3,3-dimethyl-8-(morpholin-4-yl)-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile, 6-[(3,4-dichlorophenyl)methylsulfanyl]-3,3-dimethyl-8-morpholin-4-yl-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile
| Molecular Formula | C22H23Cl2N3OS2 |
|---|---|
| Molecular Weight | 479.07 g/mol |
| LogP | 5.95688 |
| Topological Polar Surface Area | 49.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 479.06595 |
| Heavy Atoms | 30 |
| Complexity | 1000.8528 |
Chemical Identifiers
| CAS Number | 847377-91-7 |
|---|---|
| SMILES | CC1(CC2=C(CS1)C(=NC(=C2C#N)SCC3=CC(=C(C=C3)Cl)Cl)N4CCOCC4)C |
Product Overview
6-((3,4-dichlorobenzyl)thio)-3,3-dimethyl-8-morpholino-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile (CAS 847377-91-7), with molecular formula C22H23Cl2N3OS2 and molecular weight 479.07 g/mol. IUPAC: 6-[(3,4-dichlorophenyl)methylsulfanyl]-3,3-dimethyl-8-morpholin-4-yl-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile.
Chemical Property Profile of 6-((3,4-dichlorobenzyl)thio)-3,3-dimethyl-8-morpholino-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile
Property Insights of 6-((3,4-dichlorobenzyl)thio)-3,3-dimethyl-8-morpholino-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile
The XLogP value of 5.95688 indicates that 6-((3,4-dichlorobenzyl)thio)-3,3-dimethyl-8-morpholino-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.15 Ų, 6-((3,4-dichlorobenzyl)thio)-3,3-dimethyl-8-morpholino-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-((3,4-dichlorobenzyl)thio)-3,3-dimethyl-8-morpholino-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile has 0 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 6-((3,4-dichlorobenzyl)thio)-3,3-dimethyl-8-morpholino-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile?
The CAS number of 6-((3,4-dichlorobenzyl)thio)-3,3-dimethyl-8-morpholino-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile is 847377-91-7.
What is the molecular formula of 6-((3,4-dichlorobenzyl)thio)-3,3-dimethyl-8-morpholino-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile?
The molecular formula of 6-((3,4-dichlorobenzyl)thio)-3,3-dimethyl-8-morpholino-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile is C22H23Cl2N3OS2.
What is the molecular weight of 6-((3,4-dichlorobenzyl)thio)-3,3-dimethyl-8-morpholino-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile?
The molecular weight of 6-((3,4-dichlorobenzyl)thio)-3,3-dimethyl-8-morpholino-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile is 479.07 g/mol.
Where can I buy 6-((3,4-dichlorobenzyl)thio)-3,3-dimethyl-8-morpholino-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile?
You can request a quote for 6-((3,4-dichlorobenzyl)thio)-3,3-dimethyl-8-morpholino-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-((3,4-dichlorobenzyl)thio)-3,3-dimethyl-8-morpholino-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-((3,4-dichlorobenzyl)thio)-3,3-dimethyl-8-morpholino-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.