AE-848/34090054
TL;DR: AE-848/34090054 (CAS 342390-59-4) is a chemical compound with molecular formula C22H22N2O3S and molecular weight 394.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[6-methyl-3-[(3-methylphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide
Also Known As: AE-848/34090054, N-[6-methyl-3-[(3-methylphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide, N-[6-methyl-3-(3-toluidinocarbonyl)-4,5,6,7-tetrahydro-1-benzothien-2-yl]-2-furamide, N-{6-METHYL-3-[(3-METHYLPHENYL)CARBAMOYL]-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHEN-2-YL}FURAN-2-CARBOXAMIDE
| Molecular Formula | C22H22N2O3S |
|---|---|
| Molecular Weight | 394.14 g/mol |
| LogP | 5.27892 |
| Topological Polar Surface Area | 71.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 394.1351 |
| Heavy Atoms | 28 |
| Complexity | 1020.5888 |
Chemical Identifiers
| CAS Number | 342390-59-4 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC(=C2C(=O)NC3=CC=CC(=C3)C)NC(=O)C4=CC=CO4 |
Product Overview
AE-848/34090054 (CAS 342390-59-4), with molecular formula C22H22N2O3S and molecular weight 394.14 g/mol. IUPAC: N-[6-methyl-3-[(3-methylphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide.
Chemical Property Profile of AE-848/34090054
Property Insights of AE-848/34090054
The XLogP value of 5.27892 indicates that AE-848/34090054 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.34 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/34090054. Following Lipinski's Rule of Five, AE-848/34090054 has 2 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-848/34090054?
The CAS number of AE-848/34090054 is 342390-59-4.
What is the molecular formula of AE-848/34090054?
The molecular formula of AE-848/34090054 is C22H22N2O3S.
What is the molecular weight of AE-848/34090054?
The molecular weight of AE-848/34090054 is 394.14 g/mol.
Where can I buy AE-848/34090054?
You can request a quote for AE-848/34090054 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/34090054?
Yes, KEHONG BIO provides custom synthesis services for AE-848/34090054 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.