F0541-0634
TL;DR: F0541-0634 (CAS 449793-02-6) is a chemical compound with molecular formula C22H22N4O6S and molecular weight 470.126 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-butoxy-N-[2-(4-nitrophenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide
Also Known As: F0541-0634, 4-butoxy-N-(2-(4-nitrophenyl)-5,5-dioxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)benzamide, 4-butoxy-N-[2-(4-nitrophenyl)-5,5-dioxo-2H,4H,6H-5lambda6-thieno[3,4-c]pyrazol-3-yl]benzamide, 4-butoxy-N-[2-(4-nitrophenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide, 4-butoxy-N-[2-(4-nitrophenyl)-5,5-dioxido-2,6-dihydro-4H-thieno[3,4-c]pyrazol-3-yl]benzamide
Technical Specifications
| Molecular Formula | C22H22N4O6S |
| Molecular Weight | 470.126 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 144.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 470.126 Da |
| Heavy Atoms | 33 |
| Complexity | 797.0 |
| SMILES | CCCCOC1=CC=C(C=C1)C(=O)NC2=C3CS(=O)(=O)CC3=NN2C4=CC=C(C=C4)[N+](=O)[O-] |
| InChIKey | MTMSMCDTVAEPRL-UHFFFAOYSA-N |
Chemical Property Profile of F0541-0634
Property Insights of F0541-0634
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0541-0634. The TPSA of 144.0 Ų indicates high polarity, suggesting F0541-0634 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F0541-0634 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
What is the CAS number of F0541-0634?
The CAS number of F0541-0634 is 449793-02-6.
What is the molecular formula of F0541-0634?
The molecular formula of F0541-0634 is C22H22N4O6S.
What is the molecular weight of F0541-0634?
The molecular weight of F0541-0634 is 470.126 g/mol.
Where can I buy F0541-0634?
You can request a quote for F0541-0634 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for F0541-0634?
Yes, CoreyChem provides custom synthesis services for F0541-0634 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.