![ethyl 2-({[4-(diphenylmethyl)piperazin-1-yl]acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate structure](/static/products/848/848920-15-0.png)
ethyl 2-({[4-(diphenylmethyl)piperazin-1-yl]acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
TL;DR: ethyl 2-({[4-(diphenylmethyl)piperazin-1-yl]acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate (CAS 848920-15-0) is a chemical compound with molecular formula C31H37N3O4S and molecular weight 547.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-(4-benzhydrylpiperazin-1-yl)acetyl]amino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate
Also Known As: ethyl 2-({[4-(diphenylmethyl)piperazin-1-yl]acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate, ethyl 2-(2-(4-benzhydrylpiperazin-1-yl)acetamido)-5,5-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylate, ethyl 2-[[2-(4-benzhydrylpiperazin-1-yl)acetyl]amino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate
| Molecular Formula | C31H37N3O4S |
|---|---|
| Molecular Weight | 547.25 g/mol |
| LogP | 5.1218 |
| Topological Polar Surface Area | 71.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 547.2505 |
| Heavy Atoms | 39 |
| Complexity | 1244.4227 |
Chemical Identifiers
| CAS Number | 848920-15-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CC(OC2)(C)C)NC(=O)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5 |
Product Overview
ethyl 2-({[4-(diphenylmethyl)piperazin-1-yl]acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate (CAS 848920-15-0), with molecular formula C31H37N3O4S and molecular weight 547.25 g/mol. IUPAC: ethyl 2-[[2-(4-benzhydrylpiperazin-1-yl)acetyl]amino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate.
Chemical Property Profile of ethyl 2-({[4-(diphenylmethyl)piperazin-1-yl]acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
Property Insights of ethyl 2-({[4-(diphenylmethyl)piperazin-1-yl]acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
The XLogP value of 5.1218 indicates that ethyl 2-({[4-(diphenylmethyl)piperazin-1-yl]acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.11 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-({[4-(diphenylmethyl)piperazin-1-yl]acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate. Following Lipinski's Rule of Five, ethyl 2-({[4-(diphenylmethyl)piperazin-1-yl]acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ethyl 2-({[4-(diphenylmethyl)piperazin-1-yl]acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate?
The CAS number of ethyl 2-({[4-(diphenylmethyl)piperazin-1-yl]acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate is 848920-15-0.
What is the molecular formula of ethyl 2-({[4-(diphenylmethyl)piperazin-1-yl]acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate?
The molecular formula of ethyl 2-({[4-(diphenylmethyl)piperazin-1-yl]acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate is C31H37N3O4S.
What is the molecular weight of ethyl 2-({[4-(diphenylmethyl)piperazin-1-yl]acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate?
The molecular weight of ethyl 2-({[4-(diphenylmethyl)piperazin-1-yl]acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate is 547.25 g/mol.
Where can I buy ethyl 2-({[4-(diphenylmethyl)piperazin-1-yl]acetyl}amino)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate?
You can request a quote for ethyl 2-({[4-(diphenylmethyl)piperazin-1-yl]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-({[4-(diphenylmethyl)piperazin-1-yl]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-({[4-(diphenylmethyl)piperazin-1-yl]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.