AS-871/42092913
TL;DR: AS-871/42092913 (CAS 620562-98-3) is a chemical compound with molecular formula C22H25NO3S and molecular weight 383.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-(1,1-dioxothiolan-3-yl)-N-[(4-ethylphenyl)methyl]-3-phenylprop-2-enamide
Also Known As: AS-871/42092913, (2E)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(4-ethylbenzyl)-3-phenylprop-2-enamide, N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(4-ethylbenzyl)cinnamamide, N-(1,1-dioxidotetrahydro-3-thienyl)-N-(4-ethylbenzyl)-3-phenylacrylamide, (E)-N-(1,1-dioxothiolan-3-yl)-N-[(4-ethylphenyl)methyl]-3-phenylprop-2-enamide
| Molecular Formula | C22H25NO3S |
|---|---|
| Molecular Weight | 383.16 g/mol |
| LogP | 3.4781 |
| Topological Polar Surface Area | 54.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 383.15552 |
| Heavy Atoms | 27 |
| Complexity | 902.3339 |
Chemical Identifiers
| CAS Number | 620562-98-3 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)CN(C2CCS(=O)(=O)C2)C(=O)/C=C/C3=CC=CC=C3 |
Product Overview
AS-871/42092913 (CAS 620562-98-3), with molecular formula C22H25NO3S and molecular weight 383.16 g/mol. IUPAC: (E)-N-(1,1-dioxothiolan-3-yl)-N-[(4-ethylphenyl)methyl]-3-phenylprop-2-enamide.
Chemical Property Profile of AS-871/42092913
Property Insights of AS-871/42092913
The XLogP value of 3.4781 indicates that AS-871/42092913 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.45 Ų, AS-871/42092913 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AS-871/42092913 has 0 hydrogen bond donor(s) and 3 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 AS-871/42092913?
The CAS number of AS-871/42092913 is 620562-98-3.
What is the molecular formula of AS-871/42092913?
The molecular formula of AS-871/42092913 is C22H25NO3S.
What is the molecular weight of AS-871/42092913?
The molecular weight of AS-871/42092913 is 383.16 g/mol.
Where can I buy AS-871/42092913?
You can request a quote for AS-871/42092913 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/42092913?
Yes, KEHONG BIO provides custom synthesis services for AS-871/42092913 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.