AE-848/36648049
TL;DR: AE-848/36648049 (CAS 312939-69-8) is a chemical compound with molecular formula C24H28N2O6S2 and molecular weight 504.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[4-[(3-ethoxycarbonyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-4-oxobutanoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: AE-848/36648049, ethyl 2-[[4-[(3-ethoxycarbonyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-4-oxobutanoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, diethyl 2,2'-(succinylbis(azanediyl))bis(5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate), diethyl 2,2'-[(1,4-dioxobutane-1,4-diyl)diimino]bis(5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate), ETHYL 2-(3-{[3-(ETHOXYCARBONYL)-4H,5H,6H-CYCLOPENTA[B]THIOPHEN-2-YL]CARBAMOYL}PROPANAMIDO)-4H,5H,6H-CYCLOPENTA[B]THIOPHENE-3-CARBOXYLATE
| Molecular Formula | C24H28N2O6S2 |
|---|---|
| Molecular Weight | 504.14 g/mol |
| LogP | 4.4978 |
| Topological Polar Surface Area | 110.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 504.1389 |
| Heavy Atoms | 34 |
| Complexity | 1044.9309 |
Chemical Identifiers
| CAS Number | 312939-69-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)CCC(=O)NC3=C(C4=C(S3)CCC4)C(=O)OCC |
Product Overview
AE-848/36648049 (CAS 312939-69-8), with molecular formula C24H28N2O6S2 and molecular weight 504.14 g/mol. IUPAC: ethyl 2-[[4-[(3-ethoxycarbonyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-4-oxobutanoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate.
Chemical Property Profile of AE-848/36648049
Property Insights of AE-848/36648049
The XLogP value of 4.4978 indicates that AE-848/36648049 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.8 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/36648049. Following Lipinski's Rule of Five, AE-848/36648049 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AE-848/36648049?
The CAS number of AE-848/36648049 is 312939-69-8.
What is the molecular formula of AE-848/36648049?
The molecular formula of AE-848/36648049 is C24H28N2O6S2.
What is the molecular weight of AE-848/36648049?
The molecular weight of AE-848/36648049 is 504.14 g/mol.
Where can I buy AE-848/36648049?
You can request a quote for AE-848/36648049 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/36648049?
Yes, KEHONG BIO provides custom synthesis services for AE-848/36648049 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.