N-[2-[(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)amino]ethyl]furan-2-carboxamide
TL;DR: N-[2-[(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)amino]ethyl]furan-2-carboxamide (CAS 308290-50-8) is a chemical compound with molecular formula C22H28N4O2S and molecular weight 412.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)amino]ethyl]furan-2-carboxamide
Also Known As: N-[2-[(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)amino]ethyl]furan-2-carboxamide, N-(2-((8-butyl-5-cyano-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridin-6-yl)amino)ethyl)furan-2-carboxamide, N-[2-[(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)amino]ethyl]-2-furamide, N-[2-[(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)amino]ethyl]-2-furancarboxamide, N-{2-[(8-butyl-5-cyano-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridin-6-yl)amino]ethyl}furan-2-carboxamide
| Molecular Formula | C22H28N4O2S |
|---|---|
| Molecular Weight | 412.19 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 412.1933 |
| Heavy Atoms | 29 |
| Complexity | 605.0 |
Chemical Identifiers
| CAS Number | 308290-50-8 |
|---|---|
| SMILES | CCCCC1=NC(=C(C2=C1CSC(C2)(C)C)C#N)NCCNC(=O)C3=CC=CO3 |
| InChIKey | QDUBBQJWXKRPQM-UHFFFAOYSA-N |
Product Overview
N-[2-[(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)amino]ethyl]furan-2-carboxamide (CAS 308290-50-8), with molecular formula C22H28N4O2S and molecular weight 412.19 g/mol. IUPAC: N-[2-[(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)amino]ethyl]furan-2-carboxamide.
Chemical Property Profile of N-[2-[(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)amino]ethyl]furan-2-carboxamide
Property Insights of N-[2-[(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)amino]ethyl]furan-2-carboxamide
The XLogP value of 4.6 indicates that N-[2-[(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)amino]ethyl]furan-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-[(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)amino]ethyl]furan-2-carboxamide. Following Lipinski's Rule of Five, N-[2-[(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)amino]ethyl]furan-2-carboxamide has 2 hydrogen bond donor(s) and 6 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 N-[2-[(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)amino]ethyl]furan-2-carboxamide?
The CAS number of N-[2-[(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)amino]ethyl]furan-2-carboxamide is 308290-50-8.
What is the molecular formula of N-[2-[(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)amino]ethyl]furan-2-carboxamide?
The molecular formula of N-[2-[(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)amino]ethyl]furan-2-carboxamide is C22H28N4O2S.
What is the molecular weight of N-[2-[(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)amino]ethyl]furan-2-carboxamide?
The molecular weight of N-[2-[(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)amino]ethyl]furan-2-carboxamide is 412.19 g/mol.
Where can I buy N-[2-[(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)amino]ethyl]furan-2-carboxamide?
You can request a quote for N-[2-[(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)amino]ethyl]furan-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-[(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)amino]ethyl]furan-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-[(8-butyl-5-cyano-3,3-dimethyl-1,4-dihydrothiopyrano[3,4-c]pyridin-6-yl)amino]ethyl]furan-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.