AO-022/43269798
TL;DR: AO-022/43269798 (CAS 879965-87-4) is a chemical compound with molecular formula C24H26ClN3O6 and molecular weight 487.15 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)-5-(3-hydroxypropyl)-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrrolo[3,4-d]pyrazol-6-one
Also Known As: AO-022/43269798, 3-(5-chloro-2-hydroxy-4-methylphenyl)-5-(3-hydroxypropyl)-4-(3,4,5-trimethoxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one, (3Z)-3-(3-chloro-4-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-5-(3-hydroxypropyl)-4-(3,4,5-trimethoxyphenyl)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one, 3-(3-chloro-4-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-5-(3-hydroxypropyl)-4-(3,4,5-trimethoxyphenyl)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one, 3-(5-chloro-2-hydroxy-4-methylphenyl)-5-(3-hydroxypropyl)-4-(3,4,5-trimethoxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
| Molecular Formula | C24H26ClN3O6 |
|---|---|
| Molecular Weight | 487.15 g/mol |
| LogP | 3.69752 |
| Topological Polar Surface Area | 117.14 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 487.151 |
| Heavy Atoms | 34 |
| Complexity | 1216.6816 |
Chemical Identifiers
| CAS Number | 879965-87-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1Cl)C2=NNC3=C2C(N(C3=O)CCCO)C4=CC(=C(C(=C4)OC)OC)OC)O |
Product Overview
AO-022/43269798 (CAS 879965-87-4), with molecular formula C24H26ClN3O6 and molecular weight 487.15 g/mol. IUPAC: 3-(5-chloro-2-hydroxy-4-methylphenyl)-5-(3-hydroxypropyl)-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrrolo[3,4-d]pyrazol-6-one.
Chemical Property Profile of AO-022/43269798
Property Insights of AO-022/43269798
The XLogP value of 3.69752 indicates that AO-022/43269798 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.14 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43269798. Following Lipinski's Rule of Five, AO-022/43269798 has 3 hydrogen bond donor(s) and 7 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-022/43269798?
The CAS number of AO-022/43269798 is 879965-87-4.
What is the molecular formula of AO-022/43269798?
The molecular formula of AO-022/43269798 is C24H26ClN3O6.
What is the molecular weight of AO-022/43269798?
The molecular weight of AO-022/43269798 is 487.15 g/mol.
Where can I buy AO-022/43269798?
You can request a quote for AO-022/43269798 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43269798?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43269798 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.