AO-022/43390255
TL;DR: AO-022/43390255 (CAS 853753-20-5) is a chemical compound with molecular formula C23H22N4O3S and molecular weight 434.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3,4-dimethylphenyl)sulfonyl-6-imino-13-methyl-7-prop-2-enyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one
Also Known As: AO-022/43390255, 1-allyl-3-((3,4-dimethylphenyl)sulfonyl)-2-imino-8-methyl-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one, F3226-1829, 5-(3,4-dimethylbenzenesulfonyl)-6-imino-13-methyl-7-(prop-2-en-1-yl)-1,7,9-triazatricyclo[8.4.0.0^{3,8}]tetradeca-3(8),4,9,11,13-pentaen-2-one, 1-allyl-3-[(3,4-dimethylphenyl)sulfonyl]-2-imino-8-methyl-1,2-dihydro-5H-dipyrido[1,2-a:2,3-d]pyrimidin-5-one
| Molecular Formula | C23H22N4O3S |
|---|---|
| Molecular Weight | 434.14 g/mol |
| LogP | 3.07273 |
| Topological Polar Surface Area | 97.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 434.14127 |
| Heavy Atoms | 31 |
| Complexity | 1612.4906 |
Chemical Identifiers
| CAS Number | 853753-20-5 |
|---|---|
| SMILES | CC1=CN2C(=NC3=C(C2=O)C=C(C(=N)N3CC=C)S(=O)(=O)C4=CC(=C(C=C4)C)C)C=C1 |
Product Overview
AO-022/43390255 (CAS 853753-20-5), with molecular formula C23H22N4O3S and molecular weight 434.14 g/mol. IUPAC: 5-(3,4-dimethylphenyl)sulfonyl-6-imino-13-methyl-7-prop-2-enyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one.
Chemical Property Profile of AO-022/43390255
Property Insights of AO-022/43390255
The XLogP value of 3.07273 indicates that AO-022/43390255 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-022/43390255. Following Lipinski's Rule of Five, AO-022/43390255 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-022/43390255?
The CAS number of AO-022/43390255 is 853753-20-5.
What is the molecular formula of AO-022/43390255?
The molecular formula of AO-022/43390255 is C23H22N4O3S.
What is the molecular weight of AO-022/43390255?
The molecular weight of AO-022/43390255 is 434.14 g/mol.
Where can I buy AO-022/43390255?
You can request a quote for AO-022/43390255 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43390255?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43390255 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.