AE-848/08417006
TL;DR: AE-848/08417006 (CAS 1164540-30-0) is a chemical compound with molecular formula C20H12ClNO3S and molecular weight 381.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chlorophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]furan-2-carboxamide
Also Known As: AE-848/08417006, (Z)-N-(4-chlorophenyl)-N-((3-oxobenzo[b]thiophen-2(3H)-ylidene)methyl)furan-2-carboxamide, Furan-2-carboxylic acid, (4-chlorophenyl)(3-oxo-3H-benzo[b]thiophen-2-ylidenemethyl)amide, N-(4-chlorophenyl)-N-[(3-oxo-1-benzothien-2(3H)-ylidene)methyl]-2-furamide, N-(4-chlorophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2(3H)-ylidene)methyl]furan-2-carboxamide
| Molecular Formula | C20H12ClNO3S |
|---|---|
| Molecular Weight | 381.02 g/mol |
| LogP | 5.4098 |
| Topological Polar Surface Area | 50.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 381.02264 |
| Heavy Atoms | 26 |
| Complexity | 1009.8003 |
Chemical Identifiers
| CAS Number | 1164540-30-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)/C(=C/N(C3=CC=C(C=C3)Cl)C(=O)C4=CC=CO4)/S2 |
Product Overview
AE-848/08417006 (CAS 1164540-30-0), with molecular formula C20H12ClNO3S and molecular weight 381.02 g/mol. IUPAC: N-(4-chlorophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]furan-2-carboxamide.
Chemical Property Profile of AE-848/08417006
Property Insights of AE-848/08417006
The XLogP value of 5.4098 indicates that AE-848/08417006 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.52 Ų, AE-848/08417006 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AE-848/08417006 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AE-848/08417006?
The CAS number of AE-848/08417006 is 1164540-30-0.
What is the molecular formula of AE-848/08417006?
The molecular formula of AE-848/08417006 is C20H12ClNO3S.
What is the molecular weight of AE-848/08417006?
The molecular weight of AE-848/08417006 is 381.02 g/mol.
Where can I buy AE-848/08417006?
You can request a quote for AE-848/08417006 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/08417006?
Yes, KEHONG BIO provides custom synthesis services for AE-848/08417006 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.