A2558/0108969
TL;DR: A2558/0108969 (CAS 347330-20-5) is a chemical compound with molecular formula C23H28N2O7S and molecular weight 476.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-methyl-5-(pyrrolidine-1-carbonyl)-2-[(3,4,5-trimethoxybenzoyl)amino]thiophene-3-carboxylate
Also Known As: A2558/0108969, ethyl 4-methyl-5-(1-pyrrolidinylcarbonyl)-2-[(3,4,5-trimethoxybenzoyl)amino]-3-thiophenecarboxylate, ETHYL 4-METHYL-5-(PYRROLIDINE-1-CARBONYL)-2-(3,4,5-TRIMETHOXYBENZAMIDO)THIOPHENE-3-CARBOXYLATE, ethyl 4-methyl-5-(pyrrolidine-1-carbonyl)-2-[(3,4,5-trimethoxybenzoyl)amino]thiophene-3-carboxylate, ethyl 4-methyl-5-(pyrrolidin-1-ylcarbonyl)-2-{[(3,4,5-trimethoxyphenyl)carbonyl]amino}thiophene-3-carboxylate
| Molecular Formula | C23H28N2O7S |
|---|---|
| Molecular Weight | 476.16 g/mol |
| LogP | 3.74732 |
| Topological Polar Surface Area | 103.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 476.1617 |
| Heavy Atoms | 33 |
| Complexity | 1032.3147 |
Chemical Identifiers
| CAS Number | 347330-20-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)N2CCCC2)NC(=O)C3=CC(=C(C(=C3)OC)OC)OC |
Product Overview
A2558/0108969 (CAS 347330-20-5), with molecular formula C23H28N2O7S and molecular weight 476.16 g/mol. IUPAC: ethyl 4-methyl-5-(pyrrolidine-1-carbonyl)-2-[(3,4,5-trimethoxybenzoyl)amino]thiophene-3-carboxylate.
Chemical Property Profile of A2558/0108969
Property Insights of A2558/0108969
The XLogP value of 3.74732 indicates that A2558/0108969 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.4 Ų falls within the moderate polarity range, balancing permeability and solubility for A2558/0108969. Following Lipinski's Rule of Five, A2558/0108969 has 1 hydrogen bond donor(s) and 8 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 A2558/0108969?
The CAS number of A2558/0108969 is 347330-20-5.
What is the molecular formula of A2558/0108969?
The molecular formula of A2558/0108969 is C23H28N2O7S.
What is the molecular weight of A2558/0108969?
The molecular weight of A2558/0108969 is 476.16 g/mol.
Where can I buy A2558/0108969?
You can request a quote for A2558/0108969 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2558/0108969?
Yes, KEHONG BIO provides custom synthesis services for A2558/0108969 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.