AO-022/43454768
TL;DR: AO-022/43454768 (CAS 578699-62-4) is a chemical compound with molecular formula C24H19Cl2N5O3 and molecular weight 495.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dichloro-N-[5-cyano-7-(3-methoxypropyl)-11-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-6-ylidene]benzamide
Also Known As: AO-022/43454768, (E)-2,4-dichloro-N-(3-cyano-1-(3-methoxypropyl)-10-methyl-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)benzamide, 2,4-dichloro-N-[3-cyano-1-(3-methoxypropyl)-10-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidin-2-ylidene]benzamide, 2,4-Dichloro-N-[5-cyano-7-(3-methoxypropyl)-11-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-6-ylidene]benzamide, 2,4-dichloro-N-[(2E)-3-cyano-1-(3-methoxypropyl)-10-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidin-2-ylidene]benzamide
| Molecular Formula | C24H19Cl2N5O3 |
|---|---|
| Molecular Weight | 495.09 g/mol |
| LogP | 3.9137 |
| Topological Polar Surface Area | 101.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 495.0865 |
| Heavy Atoms | 34 |
| Complexity | 1616.0266 |
Chemical Identifiers
| CAS Number | 578699-62-4 |
|---|---|
| SMILES | CC1=CC=CN2C1=NC3=C(C2=O)C=C(C(=NC(=O)C4=C(C=C(C=C4)Cl)Cl)N3CCCOC)C#N |
Product Overview
AO-022/43454768 (CAS 578699-62-4), with molecular formula C24H19Cl2N5O3 and molecular weight 495.09 g/mol. IUPAC: 2,4-dichloro-N-[5-cyano-7-(3-methoxypropyl)-11-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-6-ylidene]benzamide.
Chemical Property Profile of AO-022/43454768
Property Insights of AO-022/43454768
The XLogP value of 3.9137 indicates that AO-022/43454768 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.75 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43454768. Following Lipinski's Rule of Five, AO-022/43454768 has 0 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-022/43454768?
The CAS number of AO-022/43454768 is 578699-62-4.
What is the molecular formula of AO-022/43454768?
The molecular formula of AO-022/43454768 is C24H19Cl2N5O3.
What is the molecular weight of AO-022/43454768?
The molecular weight of AO-022/43454768 is 495.09 g/mol.
Where can I buy AO-022/43454768?
You can request a quote for AO-022/43454768 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43454768?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43454768 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.