acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid structure](/static/products/904/904510-94-7.png)
2-({[(furan-2-ylmethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid
TL;DR: 2-({[(furan-2-ylmethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid (CAS 904510-94-7) is a chemical compound with molecular formula C17H18N2O6S and molecular weight 378.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-(furan-2-ylmethylamino)-2-oxoacetyl]amino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid
Also Known As: 2-({[(furan-2-ylmethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid, 2-(2-((furan-2-ylmethyl)amino)-2-oxoacetamido)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylic acid, 2-[[2-(furan-2-ylmethylamino)-2-oxoacetyl]amino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid
| Molecular Formula | C17H18N2O6S |
|---|---|
| Molecular Weight | 378.09 g/mol |
| LogP | 2.1455 |
| Topological Polar Surface Area | 117.87 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 378.08856 |
| Heavy Atoms | 26 |
| Complexity | 852.985 |
Chemical Identifiers
| CAS Number | 904510-94-7 |
|---|---|
| SMILES | CC1(CC2=C(CO1)SC(=C2C(=O)O)NC(=O)C(=O)NCC3=CC=CO3)C |
Product Overview
2-({[(furan-2-ylmethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid (CAS 904510-94-7), with molecular formula C17H18N2O6S and molecular weight 378.09 g/mol. IUPAC: 2-[[2-(furan-2-ylmethylamino)-2-oxoacetyl]amino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid.
Chemical Property Profile of 2-({[(furan-2-ylmethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid
Property Insights of 2-({[(furan-2-ylmethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid
The XLogP value of 2.1455 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-({[(furan-2-ylmethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid. The TPSA of 117.87 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-({[(furan-2-ylmethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid. Following Lipinski's Rule of Five, 2-({[(furan-2-ylmethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid has 3 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 2-({[(furan-2-ylmethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid?
The CAS number of 2-({[(furan-2-ylmethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid is 904510-94-7.
What is the molecular formula of 2-({[(furan-2-ylmethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid?
The molecular formula of 2-({[(furan-2-ylmethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid is C17H18N2O6S.
What is the molecular weight of 2-({[(furan-2-ylmethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid?
The molecular weight of 2-({[(furan-2-ylmethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid is 378.09 g/mol.
Where can I buy 2-({[(furan-2-ylmethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid?
You can request a quote for 2-({[(furan-2-ylmethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-({[(furan-2-ylmethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-({[(furan-2-ylmethyl)amino](oxo)acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.