AO-022/42490133
TL;DR: AO-022/42490133 (CAS 669748-71-4) is a chemical compound with molecular formula C27H23N3O5 and molecular weight 469.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2'-amino-6-methoxy-9,11,11-trimethyl-2,5'-dioxospiro[1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-triene-3,4'-pyrano[3,2-c]chromene]-3'-carbonitrile
Also Known As: AO-022/42490133, 2-amino-8'-methoxy-4',4',6'-trimethyl-2',5-dioxo-5',6'-dihydro-4'H,5H-spiro[pyrano[3,2-c]chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile, 2-amino-8'-methoxy-4',4',6'-trimethyl-2',5-dioxo-2',4',5',6'-tetrahydro-5H-spiro[pyrano[3,2-c]chromene-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile, 2'-Amino-6-methoxy-9,11,11-trimethyl-2,5'-dioxospiro[1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-triene-3,4'-pyrano[3,2-c]chromene]-3'-carbonitrile, 2-amino-8'-methoxy-4',4',6'-trimethyl-5',6'-dihydro-2'(1'H),5-dioxospiro(4H,5H-pyrano[3,2-c]chromene-4,1'[4'H]-pyrrolo[3,2,1-ij]quinoline)-3-carbonitrile
| Molecular Formula | C27H23N3O5 |
|---|---|
| Molecular Weight | 469.16 g/mol |
| LogP | 3.80638 |
| Topological Polar Surface Area | 118.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 469.16376 |
| Heavy Atoms | 35 |
| Complexity | 1609.5214 |
Chemical Identifiers
| CAS Number | 669748-71-4 |
|---|---|
| SMILES | CC1CC(N2C3=C1C=C(C=C3C4(C2=O)C(=C(OC5=C4C(=O)OC6=CC=CC=C65)N)C#N)OC)(C)C |
Product Overview
AO-022/42490133 (CAS 669748-71-4), with molecular formula C27H23N3O5 and molecular weight 469.16 g/mol. IUPAC: 2'-amino-6-methoxy-9,11,11-trimethyl-2,5'-dioxospiro[1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-triene-3,4'-pyrano[3,2-c]chromene]-3'-carbonitrile.
Chemical Property Profile of AO-022/42490133
Property Insights of AO-022/42490133
The XLogP value of 3.80638 indicates that AO-022/42490133 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.79 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/42490133. Following Lipinski's Rule of Five, AO-022/42490133 has 1 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-022/42490133?
The CAS number of AO-022/42490133 is 669748-71-4.
What is the molecular formula of AO-022/42490133?
The molecular formula of AO-022/42490133 is C27H23N3O5.
What is the molecular weight of AO-022/42490133?
The molecular weight of AO-022/42490133 is 469.16 g/mol.
Where can I buy AO-022/42490133?
You can request a quote for AO-022/42490133 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/42490133?
Yes, KEHONG BIO provides custom synthesis services for AO-022/42490133 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.