2-(CARBOXYFORMAMIDO)-5,5-DIMETHYL-4H,5H,7H-THIENO[2,3-C]PYRAN-3-CARBOXYLIC ACID
TL;DR: 2-(CARBOXYFORMAMIDO)-5,5-DIMETHYL-4H,5H,7H-THIENO[2,3-C]PYRAN-3-CARBOXYLIC ACID (CAS 893676-33-0) is a chemical compound with molecular formula C12H13NO6S and molecular weight 299.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5-dimethyl-2-(oxaloamino)-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid
Also Known As: 2-(CARBOXYFORMAMIDO)-5,5-DIMETHYL-4H,5H,7H-THIENO[2,3-C]PYRAN-3-CARBOXYLIC ACID, 2-(carboxyformamido)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylic acid, 3,3-dimethyl-8-(oxaloamino)-4-oxa-7-thiabicyclo[4.3.0]nona-8,10-diene-9-carboxylic Acid, 5,5-dimethyl-2-(oxaloamino)-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid, 2-[(carboxycarbonyl)amino]-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid
| Molecular Formula | C12H13NO6S |
|---|---|
| Molecular Weight | 299.05 g/mol |
| LogP | 1.3207 |
| Topological Polar Surface Area | 112.93 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 299.04636 |
| Heavy Atoms | 20 |
| Complexity | 603.33386 |
Chemical Identifiers
| CAS Number | 893676-33-0 |
|---|---|
| SMILES | CC1(CC2=C(CO1)SC(=C2C(=O)O)NC(=O)C(=O)O)C |
Product Overview
2-(CARBOXYFORMAMIDO)-5,5-DIMETHYL-4H,5H,7H-THIENO[2,3-C]PYRAN-3-CARBOXYLIC ACID (CAS 893676-33-0), with molecular formula C12H13NO6S and molecular weight 299.05 g/mol. IUPAC: 5,5-dimethyl-2-(oxaloamino)-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid.
Chemical Property Profile of 2-(CARBOXYFORMAMIDO)-5,5-DIMETHYL-4H,5H,7H-THIENO[2,3-C]PYRAN-3-CARBOXYLIC ACID
Property Insights of 2-(CARBOXYFORMAMIDO)-5,5-DIMETHYL-4H,5H,7H-THIENO[2,3-C]PYRAN-3-CARBOXYLIC ACID
The XLogP value of 1.3207 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(CARBOXYFORMAMIDO)-5,5-DIMETHYL-4H,5H,7H-THIENO[2,3-C]PYRAN-3-CARBOXYLIC ACID. The TPSA of 112.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(CARBOXYFORMAMIDO)-5,5-DIMETHYL-4H,5H,7H-THIENO[2,3-C]PYRAN-3-CARBOXYLIC ACID. Following Lipinski's Rule of Five, 2-(CARBOXYFORMAMIDO)-5,5-DIMETHYL-4H,5H,7H-THIENO[2,3-C]PYRAN-3-CARBOXYLIC ACID has 3 hydrogen bond donor(s) and 5 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-(CARBOXYFORMAMIDO)-5,5-DIMETHYL-4H,5H,7H-THIENO[2,3-C]PYRAN-3-CARBOXYLIC ACID?
The CAS number of 2-(CARBOXYFORMAMIDO)-5,5-DIMETHYL-4H,5H,7H-THIENO[2,3-C]PYRAN-3-CARBOXYLIC ACID is 893676-33-0.
What is the molecular formula of 2-(CARBOXYFORMAMIDO)-5,5-DIMETHYL-4H,5H,7H-THIENO[2,3-C]PYRAN-3-CARBOXYLIC ACID?
The molecular formula of 2-(CARBOXYFORMAMIDO)-5,5-DIMETHYL-4H,5H,7H-THIENO[2,3-C]PYRAN-3-CARBOXYLIC ACID is C12H13NO6S.
What is the molecular weight of 2-(CARBOXYFORMAMIDO)-5,5-DIMETHYL-4H,5H,7H-THIENO[2,3-C]PYRAN-3-CARBOXYLIC ACID?
The molecular weight of 2-(CARBOXYFORMAMIDO)-5,5-DIMETHYL-4H,5H,7H-THIENO[2,3-C]PYRAN-3-CARBOXYLIC ACID is 299.05 g/mol.
Where can I buy 2-(CARBOXYFORMAMIDO)-5,5-DIMETHYL-4H,5H,7H-THIENO[2,3-C]PYRAN-3-CARBOXYLIC ACID?
You can request a quote for 2-(CARBOXYFORMAMIDO)-5,5-DIMETHYL-4H,5H,7H-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-(CARBOXYFORMAMIDO)-5,5-DIMETHYL-4H,5H,7H-THIENO[2,3-C]PYRAN-3-CARBOXYLIC ACID?
Yes, KEHONG BIO provides custom synthesis services for 2-(CARBOXYFORMAMIDO)-5,5-DIMETHYL-4H,5H,7H-THIENO[2,3-C]PYRAN-3-CARBOXYLIC ACID and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.