![ethyl 2-[2-(benzylamino)acetamido]-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate structure](/static/products/371/371936-93-5.png)
ethyl 2-[2-(benzylamino)acetamido]-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate
TL;DR: ethyl 2-[2-(benzylamino)acetamido]-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate (CAS 371936-93-5) is a chemical compound with molecular formula C21H26N2O4S and molecular weight 402.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-(benzylamino)acetyl]amino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate
Also Known As: ethyl 2-[2-(benzylamino)acetamido]-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate, ethyl 2-(2-(benzylamino)acetamido)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylate, ethyl 2-[(N-benzylglycyl)amino]-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate, ethyl 2-[[2-(benzylamino)acetyl]amino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate
| Molecular Formula | C21H26N2O4S |
|---|---|
| Molecular Weight | 402.16 g/mol |
| LogP | 3.5044 |
| Topological Polar Surface Area | 76.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 402.16132 |
| Heavy Atoms | 28 |
| Complexity | 845.5905 |
Chemical Identifiers
| CAS Number | 371936-93-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CC(OC2)(C)C)NC(=O)CNCC3=CC=CC=C3 |
Product Overview
ethyl 2-[2-(benzylamino)acetamido]-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate (CAS 371936-93-5), with molecular formula C21H26N2O4S and molecular weight 402.16 g/mol. IUPAC: ethyl 2-[[2-(benzylamino)acetyl]amino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate.
Chemical Property Profile of ethyl 2-[2-(benzylamino)acetamido]-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate
Property Insights of ethyl 2-[2-(benzylamino)acetamido]-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate
The XLogP value of 3.5044 indicates that ethyl 2-[2-(benzylamino)acetamido]-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.66 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-[2-(benzylamino)acetamido]-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate. Following Lipinski's Rule of Five, ethyl 2-[2-(benzylamino)acetamido]-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate 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 ethyl 2-[2-(benzylamino)acetamido]-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate?
The CAS number of ethyl 2-[2-(benzylamino)acetamido]-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate is 371936-93-5.
What is the molecular formula of ethyl 2-[2-(benzylamino)acetamido]-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate?
The molecular formula of ethyl 2-[2-(benzylamino)acetamido]-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate is C21H26N2O4S.
What is the molecular weight of ethyl 2-[2-(benzylamino)acetamido]-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate?
The molecular weight of ethyl 2-[2-(benzylamino)acetamido]-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate is 402.16 g/mol.
Where can I buy ethyl 2-[2-(benzylamino)acetamido]-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate?
You can request a quote for ethyl 2-[2-(benzylamino)acetamido]-5,5-dimethyl-4H,5H,7H-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-(benzylamino)acetamido]-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-[2-(benzylamino)acetamido]-5,5-dimethyl-4H,5H,7H-thieno[2,3-c]pyran-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.