AE-848/11146020
TL;DR: AE-848/11146020 (CAS 120354-35-0) is a chemical compound with molecular formula C18H19NO3S and molecular weight 329.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(2-phenylacetyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: AE-848/11146020, ethyl 2-[(phenylacetyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, ethyl 2-(2-phenylacetamido)-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate, ethyl 2-[(2-phenylacetyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, ethyl 2-(2-phenylacetamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
| Molecular Formula | C18H19NO3S |
|---|---|
| Molecular Weight | 329.11 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 83.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 329.10855 |
| Heavy Atoms | 23 |
| Complexity | 436.0 |
Chemical Identifiers
| CAS Number | 120354-35-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)CC3=CC=CC=C3 |
| InChIKey | ZBXYRTPFEXLFNO-UHFFFAOYSA-N |
Product Overview
AE-848/11146020 (CAS 120354-35-0), with molecular formula C18H19NO3S and molecular weight 329.11 g/mol. IUPAC: ethyl 2-[(2-phenylacetyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate.
Chemical Property Profile of AE-848/11146020
Property Insights of AE-848/11146020
The XLogP value of 4.2 indicates that AE-848/11146020 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/11146020. Following Lipinski's Rule of Five, AE-848/11146020 has 1 hydrogen bond donor(s) and 4 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-848/11146020?
The CAS number of AE-848/11146020 is 120354-35-0.
What is the molecular formula of AE-848/11146020?
The molecular formula of AE-848/11146020 is C18H19NO3S.
What is the molecular weight of AE-848/11146020?
The molecular weight of AE-848/11146020 is 329.11 g/mol.
Where can I buy AE-848/11146020?
You can request a quote for AE-848/11146020 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/11146020?
Yes, KEHONG BIO provides custom synthesis services for AE-848/11146020 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.