F0541-0633
TL;DR: F0541-0633 (CAS 449793-00-4) is a chemical compound with molecular formula C22H22N4O5S and molecular weight 454.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-N-[2-(4-nitrophenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide
Also Known As: F0541-0633, 4-tert-butyl-N-[2-(4-nitrophenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide, 4-(tert-butyl)-N-(2-(4-nitrophenyl)-5,5-dioxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)benzamide, 4-tert-butyl-N-[2-(4-nitrophenyl)-5,5-dioxo-2H,4H,6H-5lambda6-thieno[3,4-c]pyrazol-3-yl]benzamide, 4-(2-METHYL-2-PROPANYL)-N-[2-(4-NITROPHENYL)-5,5-DIOXIDO-2,6-DIHYDRO-4H-THIENO[3,4-C]PYRAZOL-3-YL]BENZAMIDE
| Molecular Formula | C22H22N4O5S |
|---|---|
| Molecular Weight | 454.13 g/mol |
| LogP | 3.7587 |
| Topological Polar Surface Area | 124.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 454.1311 |
| Heavy Atoms | 32 |
| Complexity | 1318.381 |
Chemical Identifiers
| CAS Number | 449793-00-4 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C3CS(=O)(=O)CC3=NN2C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
F0541-0633 (CAS 449793-00-4), with molecular formula C22H22N4O5S and molecular weight 454.13 g/mol. IUPAC: 4-tert-butyl-N-[2-(4-nitrophenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide.
Chemical Property Profile of F0541-0633
Property Insights of F0541-0633
The XLogP value of 3.7587 indicates that F0541-0633 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.2 Ų falls within the moderate polarity range, balancing permeability and solubility for F0541-0633. Following Lipinski's Rule of Five, F0541-0633 has 1 hydrogen bond donor(s) and 6 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 F0541-0633?
The CAS number of F0541-0633 is 449793-00-4.
What is the molecular formula of F0541-0633?
The molecular formula of F0541-0633 is C22H22N4O5S.
What is the molecular weight of F0541-0633?
The molecular weight of F0541-0633 is 454.13 g/mol.
Where can I buy F0541-0633?
You can request a quote for F0541-0633 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0541-0633?
Yes, KEHONG BIO provides custom synthesis services for F0541-0633 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.