![ethyl 4-((3-(methoxycarbonyl)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)carbamoyl)piperazine-1-carboxylate structure](/static/products/903/903850-99-7.png)
ethyl 4-((3-(methoxycarbonyl)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)carbamoyl)piperazine-1-carboxylate
TL;DR: ethyl 4-((3-(methoxycarbonyl)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)carbamoyl)piperazine-1-carboxylate (CAS 903850-99-7) is a chemical compound with molecular formula C19H27N3O6S and molecular weight 425.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(3-methoxycarbonyl-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)carbamoyl]piperazine-1-carboxylate
Also Known As: ethyl 4-((3-(methoxycarbonyl)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)carbamoyl)piperazine-1-carboxylate, ethyl 4-[(3-methoxycarbonyl-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)carbamoyl]piperazine-1-carboxylate, ethyl 4-{[3-(methoxycarbonyl)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl]carbamoyl}piperazine-1-carboxylate
| Molecular Formula | C19H27N3O6S |
|---|---|
| Molecular Weight | 425.16 g/mol |
| LogP | 2.692 |
| Topological Polar Surface Area | 97.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 425.16205 |
| Heavy Atoms | 29 |
| Complexity | 798.1103 |
Chemical Identifiers
| CAS Number | 903850-99-7 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)NC2=C(C3=C(S2)COC(C3)(C)C)C(=O)OC |
Product Overview
ethyl 4-((3-(methoxycarbonyl)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)carbamoyl)piperazine-1-carboxylate (CAS 903850-99-7), with molecular formula C19H27N3O6S and molecular weight 425.16 g/mol. IUPAC: ethyl 4-[(3-methoxycarbonyl-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)carbamoyl]piperazine-1-carboxylate.
Chemical Property Profile of ethyl 4-((3-(methoxycarbonyl)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)carbamoyl)piperazine-1-carboxylate
Property Insights of ethyl 4-((3-(methoxycarbonyl)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)carbamoyl)piperazine-1-carboxylate
The XLogP value of 2.692 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4-((3-(methoxycarbonyl)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)carbamoyl)piperazine-1-carboxylate. The TPSA of 97.41 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-((3-(methoxycarbonyl)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)carbamoyl)piperazine-1-carboxylate. Following Lipinski's Rule of Five, ethyl 4-((3-(methoxycarbonyl)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)carbamoyl)piperazine-1-carboxylate has 1 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 4-((3-(methoxycarbonyl)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)carbamoyl)piperazine-1-carboxylate?
The CAS number of ethyl 4-((3-(methoxycarbonyl)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)carbamoyl)piperazine-1-carboxylate is 903850-99-7.
What is the molecular formula of ethyl 4-((3-(methoxycarbonyl)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)carbamoyl)piperazine-1-carboxylate?
The molecular formula of ethyl 4-((3-(methoxycarbonyl)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)carbamoyl)piperazine-1-carboxylate is C19H27N3O6S.
What is the molecular weight of ethyl 4-((3-(methoxycarbonyl)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)carbamoyl)piperazine-1-carboxylate?
The molecular weight of ethyl 4-((3-(methoxycarbonyl)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)carbamoyl)piperazine-1-carboxylate is 425.16 g/mol.
Where can I buy ethyl 4-((3-(methoxycarbonyl)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)carbamoyl)piperazine-1-carboxylate?
You can request a quote for ethyl 4-((3-(methoxycarbonyl)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)carbamoyl)piperazine-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-((3-(methoxycarbonyl)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)carbamoyl)piperazine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-((3-(methoxycarbonyl)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)carbamoyl)piperazine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.