AO-022/43454530
TL;DR: AO-022/43454530 (CAS 848752-68-1) is a chemical compound with molecular formula C25H22FN3O5S and molecular weight 495.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dimethoxyphenyl)-7-fluoro-2-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1H-chromeno[2,3-c]pyrrole-3,9-dione
Also Known As: AO-022/43454530, 1-(3,4-dimethoxyphenyl)-7-fluoro-2-(5-isobutyl-1,3,4-thiadiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione, 1-(3,4-dimethoxyphenyl)-7-fluoro-2-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1H-chromeno[2,3-c]pyrrole-3,9-dione, 1-(3,4-dimethoxyphenyl)-7-fluoro-2-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione, 1-(3,4-DIMETHOXYPHENYL)-7-FLUORO-2-[5-(2-METHYLPROPYL)-1,3,4-THIADIAZOL-2-YL]-1H,2H,3H,9H-CHROMENO[2,3-C]PYRROLE-3,9-DIONE
| Molecular Formula | C25H22FN3O5S |
|---|---|
| Molecular Weight | 495.13 g/mol |
| LogP | 4.7491 |
| Topological Polar Surface Area | 94.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 495.12643 |
| Heavy Atoms | 35 |
| Complexity | 1513.0073 |
Chemical Identifiers
| CAS Number | 848752-68-1 |
|---|---|
| SMILES | CC(C)CC1=NN=C(S1)N2C(C3=C(C2=O)OC4=C(C3=O)C=C(C=C4)F)C5=CC(=C(C=C5)OC)OC |
Product Overview
AO-022/43454530 (CAS 848752-68-1), with molecular formula C25H22FN3O5S and molecular weight 495.13 g/mol. IUPAC: 1-(3,4-dimethoxyphenyl)-7-fluoro-2-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1H-chromeno[2,3-c]pyrrole-3,9-dione.
Chemical Property Profile of AO-022/43454530
Property Insights of AO-022/43454530
The XLogP value of 4.7491 indicates that AO-022/43454530 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.76 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43454530. Following Lipinski's Rule of Five, AO-022/43454530 has 0 hydrogen bond donor(s) and 8 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-022/43454530?
The CAS number of AO-022/43454530 is 848752-68-1.
What is the molecular formula of AO-022/43454530?
The molecular formula of AO-022/43454530 is C25H22FN3O5S.
What is the molecular weight of AO-022/43454530?
The molecular weight of AO-022/43454530 is 495.13 g/mol.
Where can I buy AO-022/43454530?
You can request a quote for AO-022/43454530 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43454530?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43454530 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.