AS-871/42093436
TL;DR: AS-871/42093436 (CAS 578735-72-5) is a chemical compound with molecular formula C25H33NO4S and molecular weight 443.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-butoxy-N-(1,1-dioxothiolan-3-yl)-N-[(4-propan-2-ylphenyl)methyl]benzamide
Also Known As: AS-871/42093436, 4-butoxy-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-[4-(propan-2-yl)benzyl]benzamide, 4-butoxy-N-(1,1-dioxothiolan-3-yl)-N-[(4-propan-2-ylphenyl)methyl]benzamide, 4-butoxy-N-(1,1-dioxidotetrahydro-3-thienyl)-N-(4-isopropylbenzyl)benzamide, 4-butoxy-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(4-isopropylbenzyl)benzamide
| Molecular Formula | C25H33NO4S |
|---|---|
| Molecular Weight | 443.21 g/mol |
| LogP | 4.8184 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 443.21304 |
| Heavy Atoms | 31 |
| Complexity | 965.5865 |
Chemical Identifiers
| CAS Number | 578735-72-5 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)C(=O)N(CC2=CC=C(C=C2)C(C)C)C3CCS(=O)(=O)C3 |
Product Overview
AS-871/42093436 (CAS 578735-72-5), with molecular formula C25H33NO4S and molecular weight 443.21 g/mol. IUPAC: 4-butoxy-N-(1,1-dioxothiolan-3-yl)-N-[(4-propan-2-ylphenyl)methyl]benzamide.
Chemical Property Profile of AS-871/42093436
Property Insights of AS-871/42093436
The XLogP value of 4.8184 indicates that AS-871/42093436 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for AS-871/42093436. Following Lipinski's Rule of Five, AS-871/42093436 has 0 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 AS-871/42093436?
The CAS number of AS-871/42093436 is 578735-72-5.
What is the molecular formula of AS-871/42093436?
The molecular formula of AS-871/42093436 is C25H33NO4S.
What is the molecular weight of AS-871/42093436?
The molecular weight of AS-871/42093436 is 443.21 g/mol.
Where can I buy AS-871/42093436?
You can request a quote for AS-871/42093436 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/42093436?
Yes, KEHONG BIO provides custom synthesis services for AS-871/42093436 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.