AP-853/43093821
TL;DR: AP-853/43093821 (CAS 824980-82-7) is a chemical compound with molecular formula C20H19N3O5S and molecular weight 413.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-acetyl-4-methyl-2-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]thiophene-3-carboxylate
Also Known As: AP-853/43093821, ethyl 5-acetyl-4-methyl-2-{[(4-oxoquinazolin-3(4H)-yl)acetyl]amino}thiophene-3-carboxylate, ethyl 5-acetyl-4-methyl-2-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]thiophene-3-carboxylate, ethyl 5-acetyl-4-methyl-2-(2-(4-oxoquinazolin-3(4H)-yl)acetamido)thiophene-3-carboxylate, ethyl 5-acetyl-4-methyl-2-{[(4-oxo-3(4H)-quinazolinyl)acetyl]amino}-3-thiophenecarboxylate
| Molecular Formula | C20H19N3O5S |
|---|---|
| Molecular Weight | 413.10 g/mol |
| LogP | 2.78442 |
| Topological Polar Surface Area | 107.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.10455 |
| Heavy Atoms | 29 |
| Complexity | 1178.5637 |
Chemical Identifiers
| CAS Number | 824980-82-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)CN2C=NC3=CC=CC=C3C2=O |
Product Overview
AP-853/43093821 (CAS 824980-82-7), with molecular formula C20H19N3O5S and molecular weight 413.10 g/mol. IUPAC: ethyl 5-acetyl-4-methyl-2-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]thiophene-3-carboxylate.
Chemical Property Profile of AP-853/43093821
Property Insights of AP-853/43093821
The XLogP value of 2.78442 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AP-853/43093821. The TPSA of 107.36 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-853/43093821. Following Lipinski's Rule of Five, AP-853/43093821 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 AP-853/43093821?
The CAS number of AP-853/43093821 is 824980-82-7.
What is the molecular formula of AP-853/43093821?
The molecular formula of AP-853/43093821 is C20H19N3O5S.
What is the molecular weight of AP-853/43093821?
The molecular weight of AP-853/43093821 is 413.10 g/mol.
Where can I buy AP-853/43093821?
You can request a quote for AP-853/43093821 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-853/43093821?
Yes, KEHONG BIO provides custom synthesis services for AP-853/43093821 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.