acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate structure](/static/products/903/903855-96-9.png)
ethyl 2-({[(2-hydroxyethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
TL;DR: ethyl 2-({[(2-hydroxyethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate (CAS 903855-96-9) is a chemical compound with molecular formula C16H22N2O6S and molecular weight 370.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-(2-hydroxyethylamino)-2-oxoacetyl]amino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate
Also Known As: ethyl 2-({[(2-hydroxyethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate, ethyl 2-(2-((2-hydroxyethyl)amino)-2-oxoacetamido)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylate, ethyl 2-[[2-(2-hydroxyethylamino)-2-oxoacetyl]amino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate
| Molecular Formula | C16H22N2O6S |
|---|---|
| Molecular Weight | 370.12 g/mol |
| LogP | 0.8231 |
| Topological Polar Surface Area | 113.96 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 370.11984 |
| Heavy Atoms | 25 |
| Complexity | 682.41 |
Chemical Identifiers
| CAS Number | 903855-96-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CC(OC2)(C)C)NC(=O)C(=O)NCCO |
Product Overview
ethyl 2-({[(2-hydroxyethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate (CAS 903855-96-9), with molecular formula C16H22N2O6S and molecular weight 370.12 g/mol. IUPAC: ethyl 2-[[2-(2-hydroxyethylamino)-2-oxoacetyl]amino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate.
Chemical Property Profile of ethyl 2-({[(2-hydroxyethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
Property Insights of ethyl 2-({[(2-hydroxyethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
The XLogP value of 0.8231 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 2-({[(2-hydroxyethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate. The TPSA of 113.96 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-({[(2-hydroxyethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate. Following Lipinski's Rule of Five, ethyl 2-({[(2-hydroxyethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate has 3 hydrogen bond donor(s) and 7 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 2-({[(2-hydroxyethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate?
The CAS number of ethyl 2-({[(2-hydroxyethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate is 903855-96-9.
What is the molecular formula of ethyl 2-({[(2-hydroxyethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate?
The molecular formula of ethyl 2-({[(2-hydroxyethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate is C16H22N2O6S.
What is the molecular weight of ethyl 2-({[(2-hydroxyethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate?
The molecular weight of ethyl 2-({[(2-hydroxyethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate is 370.12 g/mol.
Where can I buy ethyl 2-({[(2-hydroxyethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate?
You can request a quote for ethyl 2-({[(2-hydroxyethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-({[(2-hydroxyethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-({[(2-hydroxyethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.