AE-848/37051078
TL;DR: AE-848/37051078 (CAS 312940-24-2) is a chemical compound with molecular formula C22H24N2O5S and molecular weight 428.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[3-(2,5-dioxopyrrolidin-1-yl)benzoyl]amino]-4-(2-methylpropyl)thiophene-3-carboxylate
Also Known As: AE-848/37051078, ethyl 2-[[3-(2,5-dioxopyrrolidin-1-yl)benzoyl]amino]-4-(2-methylpropyl)thiophene-3-carboxylate, ethyl 2-{[3-(2,5-dioxo-1-pyrrolidinyl)benzoyl]amino}-4-isobutyl-3-thiophenecarboxylate, ethyl 2-(3-(2,5-dioxopyrrolidin-1-yl)benzamido)-4-isobutylthiophene-3-carboxylate, ethyl 2-[3-(2,5-dioxopyrrolidin-1-yl)benzamido]-4-(2-methylpropyl)thiophene-3-carboxylate
| Molecular Formula | C22H24N2O5S |
|---|---|
| Molecular Weight | 428.14 g/mol |
| LogP | 4.029 |
| Topological Polar Surface Area | 92.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 428.1406 |
| Heavy Atoms | 30 |
| Complexity | 979.1641 |
Chemical Identifiers
| CAS Number | 312940-24-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC=C1CC(C)C)NC(=O)C2=CC(=CC=C2)N3C(=O)CCC3=O |
Product Overview
AE-848/37051078 (CAS 312940-24-2), with molecular formula C22H24N2O5S and molecular weight 428.14 g/mol. IUPAC: ethyl 2-[[3-(2,5-dioxopyrrolidin-1-yl)benzoyl]amino]-4-(2-methylpropyl)thiophene-3-carboxylate.
Chemical Property Profile of AE-848/37051078
Property Insights of AE-848/37051078
The XLogP value of 4.029 indicates that AE-848/37051078 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.78 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/37051078. Following Lipinski's Rule of Five, AE-848/37051078 has 1 hydrogen bond donor(s) and 6 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 AE-848/37051078?
The CAS number of AE-848/37051078 is 312940-24-2.
What is the molecular formula of AE-848/37051078?
The molecular formula of AE-848/37051078 is C22H24N2O5S.
What is the molecular weight of AE-848/37051078?
The molecular weight of AE-848/37051078 is 428.14 g/mol.
Where can I buy AE-848/37051078?
You can request a quote for AE-848/37051078 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/37051078?
Yes, KEHONG BIO provides custom synthesis services for AE-848/37051078 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.