ethyl 1-amino-5-ethyl-8,8-dimethyl-8,9-dihydro-6H-thieno[2,3-b]thiopyrano[4,3-d]pyridine-2-carboxylate
TL;DR: ethyl 1-amino-5-ethyl-8,8-dimethyl-8,9-dihydro-6H-thieno[2,3-b]thiopyrano[4,3-d]pyridine-2-carboxylate (CAS 371938-52-2) is a chemical compound with molecular formula C17H22N2O2S2 and molecular weight 350.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-amino-8-ethyl-12,12-dimethyl-5,11-dithia-7-azatricyclo[7.4.0.02,6]trideca-1(9),2(6),3,7-tetraene-4-carboxylate
Also Known As: ethyl 1-amino-5-ethyl-8,8-dimethyl-8,9-dihydro-6H-thieno[2,3-b]thiopyrano[4,3-d]pyridine-2-carboxylate
| Molecular Formula | C17H22N2O2S2 |
|---|---|
| Molecular Weight | 350.11 g/mol |
| LogP | 4.1855 |
| Topological Polar Surface Area | 65.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 350.11227 |
| Heavy Atoms | 23 |
| Complexity | 780.72675 |
Chemical Identifiers
| CAS Number | 371938-52-2 |
|---|---|
| SMILES | CCC1=NC2=C(C3=C1CSC(C3)(C)C)C(=C(S2)C(=O)OCC)N |
Product Overview
ethyl 1-amino-5-ethyl-8,8-dimethyl-8,9-dihydro-6H-thieno[2,3-b]thiopyrano[4,3-d]pyridine-2-carboxylate (CAS 371938-52-2), with molecular formula C17H22N2O2S2 and molecular weight 350.11 g/mol. IUPAC: ethyl 3-amino-8-ethyl-12,12-dimethyl-5,11-dithia-7-azatricyclo[7.4.0.02,6]trideca-1(9),2(6),3,7-tetraene-4-carboxylate.
Chemical Property Profile of ethyl 1-amino-5-ethyl-8,8-dimethyl-8,9-dihydro-6H-thieno[2,3-b]thiopyrano[4,3-d]pyridine-2-carboxylate
Property Insights of ethyl 1-amino-5-ethyl-8,8-dimethyl-8,9-dihydro-6H-thieno[2,3-b]thiopyrano[4,3-d]pyridine-2-carboxylate
The XLogP value of 4.1855 indicates that ethyl 1-amino-5-ethyl-8,8-dimethyl-8,9-dihydro-6H-thieno[2,3-b]thiopyrano[4,3-d]pyridine-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.21 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 1-amino-5-ethyl-8,8-dimethyl-8,9-dihydro-6H-thieno[2,3-b]thiopyrano[4,3-d]pyridine-2-carboxylate. Following Lipinski's Rule of Five, ethyl 1-amino-5-ethyl-8,8-dimethyl-8,9-dihydro-6H-thieno[2,3-b]thiopyrano[4,3-d]pyridine-2-carboxylate has 1 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 ethyl 1-amino-5-ethyl-8,8-dimethyl-8,9-dihydro-6H-thieno[2,3-b]thiopyrano[4,3-d]pyridine-2-carboxylate?
The CAS number of ethyl 1-amino-5-ethyl-8,8-dimethyl-8,9-dihydro-6H-thieno[2,3-b]thiopyrano[4,3-d]pyridine-2-carboxylate is 371938-52-2.
What is the molecular formula of ethyl 1-amino-5-ethyl-8,8-dimethyl-8,9-dihydro-6H-thieno[2,3-b]thiopyrano[4,3-d]pyridine-2-carboxylate?
The molecular formula of ethyl 1-amino-5-ethyl-8,8-dimethyl-8,9-dihydro-6H-thieno[2,3-b]thiopyrano[4,3-d]pyridine-2-carboxylate is C17H22N2O2S2.
What is the molecular weight of ethyl 1-amino-5-ethyl-8,8-dimethyl-8,9-dihydro-6H-thieno[2,3-b]thiopyrano[4,3-d]pyridine-2-carboxylate?
The molecular weight of ethyl 1-amino-5-ethyl-8,8-dimethyl-8,9-dihydro-6H-thieno[2,3-b]thiopyrano[4,3-d]pyridine-2-carboxylate is 350.11 g/mol.
Where can I buy ethyl 1-amino-5-ethyl-8,8-dimethyl-8,9-dihydro-6H-thieno[2,3-b]thiopyrano[4,3-d]pyridine-2-carboxylate?
You can request a quote for ethyl 1-amino-5-ethyl-8,8-dimethyl-8,9-dihydro-6H-thieno[2,3-b]thiopyrano[4,3-d]pyridine-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 1-amino-5-ethyl-8,8-dimethyl-8,9-dihydro-6H-thieno[2,3-b]thiopyrano[4,3-d]pyridine-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 1-amino-5-ethyl-8,8-dimethyl-8,9-dihydro-6H-thieno[2,3-b]thiopyrano[4,3-d]pyridine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.