AE-848/13008260
TL;DR: AE-848/13008260 (CAS 380644-72-4) is a chemical compound with molecular formula C29H27NO6S and molecular weight 517.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-phenylphenyl)-2-[(3,4,5-trimethoxybenzoyl)amino]thiophene-3-carboxylate
Also Known As: AE-848/13008260, ethyl 4-(4-phenylphenyl)-2-[(3,4,5-trimethoxybenzoyl)amino]thiophene-3-carboxylate, ethyl 4-(biphenyl-4-yl)-2-{[(3,4,5-trimethoxyphenyl)carbonyl]amino}thiophene-3-carboxylate, ethyl 4-([1,1'-biphenyl]-4-yl)-2-(3,4,5-trimethoxybenzamido)thiophene-3-carboxylate, ethyl 4-[1,1'-biphenyl]-4-yl-2-[(3,4,5-trimethoxybenzoyl)amino]-3-thiophenecarboxylate
| Molecular Formula | C29H27NO6S |
|---|---|
| Molecular Weight | 517.16 g/mol |
| LogP | 6.5369 |
| Topological Polar Surface Area | 83.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 517.1559 |
| Heavy Atoms | 37 |
| Complexity | 1370.9265 |
Chemical Identifiers
| CAS Number | 380644-72-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C3=CC=CC=C3)NC(=O)C4=CC(=C(C(=C4)OC)OC)OC |
Product Overview
AE-848/13008260 (CAS 380644-72-4), with molecular formula C29H27NO6S and molecular weight 517.16 g/mol. IUPAC: ethyl 4-(4-phenylphenyl)-2-[(3,4,5-trimethoxybenzoyl)amino]thiophene-3-carboxylate.
Chemical Property Profile of AE-848/13008260
Property Insights of AE-848/13008260
The XLogP value of 6.5369 indicates that AE-848/13008260 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.09 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/13008260. Following Lipinski's Rule of Five, AE-848/13008260 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 AE-848/13008260?
The CAS number of AE-848/13008260 is 380644-72-4.
What is the molecular formula of AE-848/13008260?
The molecular formula of AE-848/13008260 is C29H27NO6S.
What is the molecular weight of AE-848/13008260?
The molecular weight of AE-848/13008260 is 517.16 g/mol.
Where can I buy AE-848/13008260?
You can request a quote for AE-848/13008260 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/13008260?
Yes, KEHONG BIO provides custom synthesis services for AE-848/13008260 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.