F0541-0648
TL;DR: F0541-0648 (CAS 450336-49-9) is a chemical compound with molecular formula C19H15ClN4O6S and molecular weight 462.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-2-methoxy-N-[2-(4-nitrophenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide
Also Known As: F0541-0648, 5-chloro-2-methoxy-N-[2-(4-nitrophenyl)-5,5-dioxo-2H,4H,6H-5lambda6-thieno[3,4-c]pyrazol-3-yl]benzamide, 5-chloro-2-methoxy-N-(2-(4-nitrophenyl)-5,5-dioxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)benzamide, 5-chloro-2-methoxy-N-[2-(4-nitrophenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide, 5-chloro-2-methoxy-N-[2-(4-nitrophenyl)-5,5-dioxido-2,6-dihydro-4H-thieno[3,4-c]pyrazol-3-yl]benzamide
| Molecular Formula | C19H15ClN4O6S |
|---|---|
| Molecular Weight | 462.04 g/mol |
| LogP | 3.1232 |
| Topological Polar Surface Area | 133.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 462.04007 |
| Heavy Atoms | 31 |
| Complexity | 1317.9111 |
Chemical Identifiers
| CAS Number | 450336-49-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Cl)C(=O)NC2=C3CS(=O)(=O)CC3=NN2C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
F0541-0648 (CAS 450336-49-9), with molecular formula C19H15ClN4O6S and molecular weight 462.04 g/mol. IUPAC: 5-chloro-2-methoxy-N-[2-(4-nitrophenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide.
Chemical Property Profile of F0541-0648
Property Insights of F0541-0648
The XLogP value of 3.1232 indicates that F0541-0648 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 133.43 Ų falls within the moderate polarity range, balancing permeability and solubility for F0541-0648. Following Lipinski's Rule of Five, F0541-0648 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 F0541-0648?
The CAS number of F0541-0648 is 450336-49-9.
What is the molecular formula of F0541-0648?
The molecular formula of F0541-0648 is C19H15ClN4O6S.
What is the molecular weight of F0541-0648?
The molecular weight of F0541-0648 is 462.04 g/mol.
Where can I buy F0541-0648?
You can request a quote for F0541-0648 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0541-0648?
Yes, KEHONG BIO provides custom synthesis services for F0541-0648 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.