2-methoxyethyl 5-cyano-6-((2-(cyclohexylamino)-2-oxoethyl)thio)-4-(furan-2-yl)-2-methylnicotinate
TL;DR: 2-methoxyethyl 5-cyano-6-((2-(cyclohexylamino)-2-oxoethyl)thio)-4-(furan-2-yl)-2-methylnicotinate (CAS 799802-62-3) is a chemical compound with molecular formula C23H27N3O5S and molecular weight 457.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxyethyl 5-cyano-6-[2-(cyclohexylamino)-2-oxoethyl]sulfanyl-4-(furan-2-yl)-2-methylpyridine-3-carboxylate
Also Known As: 2-methoxyethyl 5-cyano-6-((2-(cyclohexylamino)-2-oxoethyl)thio)-4-(furan-2-yl)-2-methylnicotinate, 2-methoxyethyl 5-cyano-6-[2-(cyclohexylamino)-2-oxoethyl]sulfanyl-4-(furan-2-yl)-2-methylpyridine-3-carboxylate, 2-methoxyethyl 5-cyano-6-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-(furan-2-yl)-2-methylpyridine-3-carboxylate
| Molecular Formula | C23H27N3O5S |
|---|---|
| Molecular Weight | 457.17 g/mol |
| LogP | 3.8659 |
| Topological Polar Surface Area | 114.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 457.16714 |
| Heavy Atoms | 32 |
| Complexity | 978.5035 |
Chemical Identifiers
| CAS Number | 799802-62-3 |
|---|---|
| SMILES | CC1=C(C(=C(C(=N1)SCC(=O)NC2CCCCC2)C#N)C3=CC=CO3)C(=O)OCCOC |
Product Overview
2-methoxyethyl 5-cyano-6-((2-(cyclohexylamino)-2-oxoethyl)thio)-4-(furan-2-yl)-2-methylnicotinate (CAS 799802-62-3), with molecular formula C23H27N3O5S and molecular weight 457.17 g/mol. IUPAC: 2-methoxyethyl 5-cyano-6-[2-(cyclohexylamino)-2-oxoethyl]sulfanyl-4-(furan-2-yl)-2-methylpyridine-3-carboxylate.
Chemical Property Profile of 2-methoxyethyl 5-cyano-6-((2-(cyclohexylamino)-2-oxoethyl)thio)-4-(furan-2-yl)-2-methylnicotinate
Property Insights of 2-methoxyethyl 5-cyano-6-((2-(cyclohexylamino)-2-oxoethyl)thio)-4-(furan-2-yl)-2-methylnicotinate
The XLogP value of 3.8659 indicates that 2-methoxyethyl 5-cyano-6-((2-(cyclohexylamino)-2-oxoethyl)thio)-4-(furan-2-yl)-2-methylnicotinate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methoxyethyl 5-cyano-6-((2-(cyclohexylamino)-2-oxoethyl)thio)-4-(furan-2-yl)-2-methylnicotinate. Following Lipinski's Rule of Five, 2-methoxyethyl 5-cyano-6-((2-(cyclohexylamino)-2-oxoethyl)thio)-4-(furan-2-yl)-2-methylnicotinate has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-methoxyethyl 5-cyano-6-((2-(cyclohexylamino)-2-oxoethyl)thio)-4-(furan-2-yl)-2-methylnicotinate?
The CAS number of 2-methoxyethyl 5-cyano-6-((2-(cyclohexylamino)-2-oxoethyl)thio)-4-(furan-2-yl)-2-methylnicotinate is 799802-62-3.
What is the molecular formula of 2-methoxyethyl 5-cyano-6-((2-(cyclohexylamino)-2-oxoethyl)thio)-4-(furan-2-yl)-2-methylnicotinate?
The molecular formula of 2-methoxyethyl 5-cyano-6-((2-(cyclohexylamino)-2-oxoethyl)thio)-4-(furan-2-yl)-2-methylnicotinate is C23H27N3O5S.
What is the molecular weight of 2-methoxyethyl 5-cyano-6-((2-(cyclohexylamino)-2-oxoethyl)thio)-4-(furan-2-yl)-2-methylnicotinate?
The molecular weight of 2-methoxyethyl 5-cyano-6-((2-(cyclohexylamino)-2-oxoethyl)thio)-4-(furan-2-yl)-2-methylnicotinate is 457.17 g/mol.
Where can I buy 2-methoxyethyl 5-cyano-6-((2-(cyclohexylamino)-2-oxoethyl)thio)-4-(furan-2-yl)-2-methylnicotinate?
You can request a quote for 2-methoxyethyl 5-cyano-6-((2-(cyclohexylamino)-2-oxoethyl)thio)-4-(furan-2-yl)-2-methylnicotinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methoxyethyl 5-cyano-6-((2-(cyclohexylamino)-2-oxoethyl)thio)-4-(furan-2-yl)-2-methylnicotinate?
Yes, KEHONG BIO provides custom synthesis services for 2-methoxyethyl 5-cyano-6-((2-(cyclohexylamino)-2-oxoethyl)thio)-4-(furan-2-yl)-2-methylnicotinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.