F0541-0333
TL;DR: F0541-0333 (CAS 449787-42-2) is a chemical compound with molecular formula C21H21N3O4S and molecular weight 411.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethoxy-N-[2-(4-methylphenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide
Also Known As: F0541-0333, N-(5,5-dioxido-2-(p-tolyl)-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-4-ethoxybenzamide, 4-ethoxy-N-[2-(4-methylphenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide, 4-ethoxy-N-[2-(4-methylphenyl)-5,5-dioxo-2H,4H,6H-5lambda6-thieno[3,4-c]pyrazol-3-yl]benzamide
| Molecular Formula | C21H21N3O4S |
|---|---|
| Molecular Weight | 411.13 g/mol |
| LogP | 3.26012 |
| Topological Polar Surface Area | 90.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 411.12527 |
| Heavy Atoms | 29 |
| Complexity | 1163.8854 |
Chemical Identifiers
| CAS Number | 449787-42-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C(=O)NC2=C3CS(=O)(=O)CC3=NN2C4=CC=C(C=C4)C |
Product Overview
F0541-0333 (CAS 449787-42-2), with molecular formula C21H21N3O4S and molecular weight 411.13 g/mol. IUPAC: 4-ethoxy-N-[2-(4-methylphenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide.
Chemical Property Profile of F0541-0333
Property Insights of F0541-0333
The XLogP value of 3.26012 indicates that F0541-0333 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.29 Ų falls within the moderate polarity range, balancing permeability and solubility for F0541-0333. Following Lipinski's Rule of Five, F0541-0333 has 1 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 F0541-0333?
The CAS number of F0541-0333 is 449787-42-2.
What is the molecular formula of F0541-0333?
The molecular formula of F0541-0333 is C21H21N3O4S.
What is the molecular weight of F0541-0333?
The molecular weight of F0541-0333 is 411.13 g/mol.
Where can I buy F0541-0333?
You can request a quote for F0541-0333 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0541-0333?
Yes, KEHONG BIO provides custom synthesis services for F0541-0333 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.