AO-022/43454717
TL;DR: AO-022/43454717 (CAS 893349-32-1) is a chemical compound with molecular formula C21H18BrFN2O3 and molecular weight 444.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-bromo-2-[2-(dimethylamino)ethyl]-1-(3-fluorophenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione
Also Known As: AO-022/43454717, 7-bromo-2-[2-(dimethylamino)ethyl]-1-(3-fluorophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione, 7-BROMO-2-[2-(DIMETHYLAMINO)ETHYL]-1-(3-FLUOROPHENYL)-1H-CHROMENO[2,3-C]PYRROLE-3,9-DIONE, 7-bromo-2-(2-dimethylaminoethyl)-1-(3-fluorophenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione, 7-bromo-2-(2-(dimethylamino)ethyl)-1-(3-fluorophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
| Molecular Formula | C21H18BrFN2O3 |
|---|---|
| Molecular Weight | 444.05 g/mol |
| LogP | 3.8014 |
| Topological Polar Surface Area | 53.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 444.0485 |
| Heavy Atoms | 28 |
| Complexity | 1142.1891 |
Chemical Identifiers
| CAS Number | 893349-32-1 |
|---|---|
| SMILES | CN(C)CCN1C(C2=C(C1=O)OC3=C(C2=O)C=C(C=C3)Br)C4=CC(=CC=C4)F |
Product Overview
AO-022/43454717 (CAS 893349-32-1), with molecular formula C21H18BrFN2O3 and molecular weight 444.05 g/mol. IUPAC: 7-bromo-2-[2-(dimethylamino)ethyl]-1-(3-fluorophenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione.
Chemical Property Profile of AO-022/43454717
Property Insights of AO-022/43454717
The XLogP value of 3.8014 indicates that AO-022/43454717 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.76 Ų, AO-022/43454717 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AO-022/43454717 has 0 hydrogen bond donor(s) and 4 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-022/43454717?
The CAS number of AO-022/43454717 is 893349-32-1.
What is the molecular formula of AO-022/43454717?
The molecular formula of AO-022/43454717 is C21H18BrFN2O3.
What is the molecular weight of AO-022/43454717?
The molecular weight of AO-022/43454717 is 444.05 g/mol.
Where can I buy AO-022/43454717?
You can request a quote for AO-022/43454717 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43454717?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43454717 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.