AE-848/12123149
TL;DR: AE-848/12123149 (CAS 342378-85-2) is a chemical compound with molecular formula C19H19NO5S and molecular weight 373.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(3-acetyloxybenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: AE-848/12123149, ethyl 2-(3-acetoxybenzamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, ethyl 2-{[3-(acetyloxy)benzoyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, ethyl 2-({[3-(acetyloxy)phenyl]carbonyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
| Molecular Formula | C19H19NO5S |
|---|---|
| Molecular Weight | 373.10 g/mol |
| LogP | 3.5911 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 373.0984 |
| Heavy Atoms | 26 |
| Complexity | 870.8096 |
Chemical Identifiers
| CAS Number | 342378-85-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=CC(=CC=C3)OC(=O)C |
Product Overview
AE-848/12123149 (CAS 342378-85-2), with molecular formula C19H19NO5S and molecular weight 373.10 g/mol. IUPAC: ethyl 2-[(3-acetyloxybenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate.
Chemical Property Profile of AE-848/12123149
Property Insights of AE-848/12123149
The XLogP value of 3.5911 indicates that AE-848/12123149 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/12123149. Following Lipinski's Rule of Five, AE-848/12123149 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-848/12123149?
The CAS number of AE-848/12123149 is 342378-85-2.
What is the molecular formula of AE-848/12123149?
The molecular formula of AE-848/12123149 is C19H19NO5S.
What is the molecular weight of AE-848/12123149?
The molecular weight of AE-848/12123149 is 373.10 g/mol.
Where can I buy AE-848/12123149?
You can request a quote for AE-848/12123149 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/12123149?
Yes, KEHONG BIO provides custom synthesis services for AE-848/12123149 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.