AO-022/42093445
TL;DR: AO-022/42093445 (CAS 586990-95-6) 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.
N-(1,1-dioxothiolan-3-yl)-4-(2-methylpropoxy)-N-[(4-propan-2-ylphenyl)methyl]benzamide
Also Known As: AO-022/42093445, N-(1,1-dioxidotetrahydrothiophen-3-yl)-4-(2-methylpropoxy)-N-[4-(propan-2-yl)benzyl]benzamide, N-(1,1-dioxothiolan-3-yl)-4-(2-methylpropoxy)-N-[(4-propan-2-ylphenyl)methyl]benzamide, N-(1,1-dioxidotetrahydro-3-thienyl)-4-isobutoxy-N-(4-isopropylbenzyl)benzamide, N-(1,1-dioxidotetrahydrothiophen-3-yl)-4-isobutoxy-N-(4-isopropylbenzyl)benzamide
| Molecular Formula | C25H33NO4S |
|---|---|
| Molecular Weight | 443.21 g/mol |
| LogP | 4.6743 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 443.21304 |
| Heavy Atoms | 31 |
| Complexity | 979.187 |
Chemical Identifiers
| CAS Number | 586990-95-6 |
|---|---|
| SMILES | CC(C)COC1=CC=C(C=C1)C(=O)N(CC2=CC=C(C=C2)C(C)C)C3CCS(=O)(=O)C3 |
Product Overview
AO-022/42093445 (CAS 586990-95-6), with molecular formula C25H33NO4S and molecular weight 443.21 g/mol. IUPAC: N-(1,1-dioxothiolan-3-yl)-4-(2-methylpropoxy)-N-[(4-propan-2-ylphenyl)methyl]benzamide.
Chemical Property Profile of AO-022/42093445
Property Insights of AO-022/42093445
The XLogP value of 4.6743 indicates that AO-022/42093445 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 AO-022/42093445. Following Lipinski's Rule of Five, AO-022/42093445 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 AO-022/42093445?
The CAS number of AO-022/42093445 is 586990-95-6.
What is the molecular formula of AO-022/42093445?
The molecular formula of AO-022/42093445 is C25H33NO4S.
What is the molecular weight of AO-022/42093445?
The molecular weight of AO-022/42093445 is 443.21 g/mol.
Where can I buy AO-022/42093445?
You can request a quote for AO-022/42093445 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/42093445?
Yes, KEHONG BIO provides custom synthesis services for AO-022/42093445 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.