ethyl 2-((2-(benzoyloxy)-5-methoxybenzyl)amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
TL;DR: ethyl 2-((2-(benzoyloxy)-5-methoxybenzyl)amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate (CAS 373368-72-0) is a chemical compound with molecular formula C25H25NO5S and molecular weight 451.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(2-benzoyloxy-5-methoxyphenyl)methylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: ethyl 2-((2-(benzoyloxy)-5-methoxybenzyl)amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, ETHYL 2-({[2-(BENZOYLOXY)-5-METHOXYPHENYL]METHYL}AMINO)-4H,5H,6H-CYCLOPENTA[B]THIOPHENE-3-CARBOXYLATE, ethyl 2-({5-methoxy-2-[(phenylcarbonyl)oxy]benzyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, ethyl 2-[(2-benzoyloxy-5-methoxyphenyl)methylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
| Molecular Formula | C25H25NO5S |
|---|---|
| Molecular Weight | 451.15 g/mol |
| LogP | 5.2534 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 451.14536 |
| Heavy Atoms | 32 |
| Complexity | 1122.861 |
Chemical Identifiers
| CAS Number | 373368-72-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCC2)NCC3=C(C=CC(=C3)OC)OC(=O)C4=CC=CC=C4 |
Product Overview
ethyl 2-((2-(benzoyloxy)-5-methoxybenzyl)amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate (CAS 373368-72-0), with molecular formula C25H25NO5S and molecular weight 451.15 g/mol. IUPAC: ethyl 2-[(2-benzoyloxy-5-methoxyphenyl)methylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate.
Chemical Property Profile of ethyl 2-((2-(benzoyloxy)-5-methoxybenzyl)amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Property Insights of ethyl 2-((2-(benzoyloxy)-5-methoxybenzyl)amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
The XLogP value of 5.2534 indicates that ethyl 2-((2-(benzoyloxy)-5-methoxybenzyl)amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-((2-(benzoyloxy)-5-methoxybenzyl)amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate. Following Lipinski's Rule of Five, ethyl 2-((2-(benzoyloxy)-5-methoxybenzyl)amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-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-((2-(benzoyloxy)-5-methoxybenzyl)amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate?
The CAS number of ethyl 2-((2-(benzoyloxy)-5-methoxybenzyl)amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate is 373368-72-0.
What is the molecular formula of ethyl 2-((2-(benzoyloxy)-5-methoxybenzyl)amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate?
The molecular formula of ethyl 2-((2-(benzoyloxy)-5-methoxybenzyl)amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate is C25H25NO5S.
What is the molecular weight of ethyl 2-((2-(benzoyloxy)-5-methoxybenzyl)amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate?
The molecular weight of ethyl 2-((2-(benzoyloxy)-5-methoxybenzyl)amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate is 451.15 g/mol.
Where can I buy ethyl 2-((2-(benzoyloxy)-5-methoxybenzyl)amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate?
You can request a quote for ethyl 2-((2-(benzoyloxy)-5-methoxybenzyl)amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-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-(benzoyloxy)-5-methoxybenzyl)amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-((2-(benzoyloxy)-5-methoxybenzyl)amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.