AO-022/42864007
TL;DR: AO-022/42864007 (CAS 606964-60-7) is a chemical compound with molecular formula C23H23ClN4O3S and molecular weight 470.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-chlorophenyl)sulfonyl-6-imino-13-methyl-7-pentyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one
Also Known As: AO-022/42864007, 3-[(4-chlorophenyl)sulfonyl]-2-imino-8-methyl-1-pentyl-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one, 3-[(4-chlorophenyl)sulfonyl]-2-imino-8-methyl-1-pentyl-1,2-dihydro-5H-dipyrido[1,2-a:2,3-d]pyrimidin-5-one, 5-(4-Chlorophenyl)sulfonyl-6-imino-13-methyl-7-pentyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one, 3-((4-chlorophenyl)sulfonyl)-2-imino-8-methyl-1-pentyl-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one
| Molecular Formula | C23H23ClN4O3S |
|---|---|
| Molecular Weight | 470.12 g/mol |
| LogP | 4.11349 |
| Topological Polar Surface Area | 97.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 470.11795 |
| Heavy Atoms | 32 |
| Complexity | 1555.2642 |
Chemical Identifiers
| CAS Number | 606964-60-7 |
|---|---|
| SMILES | CCCCCN1C2=C(C=C(C1=N)S(=O)(=O)C3=CC=C(C=C3)Cl)C(=O)N4C=C(C=CC4=N2)C |
Product Overview
AO-022/42864007 (CAS 606964-60-7), with molecular formula C23H23ClN4O3S and molecular weight 470.12 g/mol. IUPAC: 5-(4-chlorophenyl)sulfonyl-6-imino-13-methyl-7-pentyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one.
Chemical Property Profile of AO-022/42864007
Property Insights of AO-022/42864007
The XLogP value of 4.11349 indicates that AO-022/42864007 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.29 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/42864007. Following Lipinski's Rule of Five, AO-022/42864007 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-022/42864007?
The CAS number of AO-022/42864007 is 606964-60-7.
What is the molecular formula of AO-022/42864007?
The molecular formula of AO-022/42864007 is C23H23ClN4O3S.
What is the molecular weight of AO-022/42864007?
The molecular weight of AO-022/42864007 is 470.12 g/mol.
Where can I buy AO-022/42864007?
You can request a quote for AO-022/42864007 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/42864007?
Yes, KEHONG BIO provides custom synthesis services for AO-022/42864007 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.