AO-022/43406712
TL;DR: AO-022/43406712 (CAS 845985-75-3) is a chemical compound with molecular formula C21H19N3O2S and molecular weight 377.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-ethylphenyl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Also Known As: AO-022/43406712, N-(4-ethylphenyl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide, N-(4-ethylphenyl)-2-[(2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide, N-(4-ethylphenyl)-2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)acetamide
| Molecular Formula | C21H19N3O2S |
|---|---|
| Molecular Weight | 377.12 g/mol |
| LogP | 4.97762 |
| Topological Polar Surface Area | 68.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 377.1198 |
| Heavy Atoms | 27 |
| Complexity | 1119.6473 |
Chemical Identifiers
| CAS Number | 845985-75-3 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)NC(=O)CSC2=NC(=NC3=C2OC4=CC=CC=C43)C |
Product Overview
AO-022/43406712 (CAS 845985-75-3), with molecular formula C21H19N3O2S and molecular weight 377.12 g/mol. IUPAC: N-(4-ethylphenyl)-2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide.
Chemical Property Profile of AO-022/43406712
Property Insights of AO-022/43406712
The XLogP value of 4.97762 indicates that AO-022/43406712 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.02 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43406712. Following Lipinski's Rule of Five, AO-022/43406712 has 1 hydrogen bond donor(s) and 5 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-022/43406712?
The CAS number of AO-022/43406712 is 845985-75-3.
What is the molecular formula of AO-022/43406712?
The molecular formula of AO-022/43406712 is C21H19N3O2S.
What is the molecular weight of AO-022/43406712?
The molecular weight of AO-022/43406712 is 377.12 g/mol.
Where can I buy AO-022/43406712?
You can request a quote for AO-022/43406712 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43406712?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43406712 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.