AO-022/43270039
TL;DR: AO-022/43270039 (CAS 866245-75-2) is a chemical compound with molecular formula C22H22ClN3O4 and molecular weight 427.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5-chloro-2-hydroxy-4-methylphenyl)-4-(4-ethoxyphenyl)-5-(2-hydroxyethyl)-1,4-dihydropyrrolo[3,4-d]pyrazol-6-one
Also Known As: AO-022/43270039, 3-(5-chloro-2-hydroxy-4-methylphenyl)-4-(4-ethoxyphenyl)-5-(2-hydroxyethyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one, (3Z)-3-(3-chloro-4-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-4-(4-ethoxyphenyl)-5-(2-hydroxyethyl)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one, 3-(5-Chloro-2-hydroxy-4-methylphenyl)-4-(4-ethoxyphenyl)-5-(2-hydroxyethyl)-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one, 3-(3-chloro-4-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-4-(4-ethoxyphenyl)-5-(2-hydroxyethyl)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one
| Molecular Formula | C22H22ClN3O4 |
|---|---|
| Molecular Weight | 427.13 g/mol |
| LogP | 3.68032 |
| Topological Polar Surface Area | 98.68 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 427.12988 |
| Heavy Atoms | 30 |
| Complexity | 1094.5072 |
Chemical Identifiers
| CAS Number | 866245-75-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C2C3=C(C(=O)N2CCO)NN=C3C4=C(C=C(C(=C4)Cl)C)O |
Product Overview
AO-022/43270039 (CAS 866245-75-2), with molecular formula C22H22ClN3O4 and molecular weight 427.13 g/mol. IUPAC: 3-(5-chloro-2-hydroxy-4-methylphenyl)-4-(4-ethoxyphenyl)-5-(2-hydroxyethyl)-1,4-dihydropyrrolo[3,4-d]pyrazol-6-one.
Chemical Property Profile of AO-022/43270039
Property Insights of AO-022/43270039
The XLogP value of 3.68032 indicates that AO-022/43270039 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.68 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43270039. Following Lipinski's Rule of Five, AO-022/43270039 has 3 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-022/43270039?
The CAS number of AO-022/43270039 is 866245-75-2.
What is the molecular formula of AO-022/43270039?
The molecular formula of AO-022/43270039 is C22H22ClN3O4.
What is the molecular weight of AO-022/43270039?
The molecular weight of AO-022/43270039 is 427.13 g/mol.
Where can I buy AO-022/43270039?
You can request a quote for AO-022/43270039 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43270039?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43270039 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.