F0561-0445
TL;DR: F0561-0445 (CAS 1007195-24-5) is a chemical compound with molecular formula C18H13ClN4O4S and molecular weight 416.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(3-chlorophenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-nitrobenzamide
Also Known As: F0561-0445, N-[2-(3-chlorophenyl)-5-oxo-2H,4H,6H-5lambda4-thieno[3,4-c]pyrazol-3-yl]-2-nitrobenzamide, N-[2-(3-chlorophenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-nitrobenzamide, N-(2-(3-chlorophenyl)-5-oxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-2-nitrobenzamide
| Molecular Formula | C18H13ClN4O4S |
|---|---|
| Molecular Weight | 416.03 g/mol |
| LogP | 3.4485 |
| Topological Polar Surface Area | 107.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 416.0346 |
| Heavy Atoms | 28 |
| Complexity | 1144.3644 |
Chemical Identifiers
| CAS Number | 1007195-24-5 |
|---|---|
| SMILES | C1C2=C(N(N=C2CS1=O)C3=CC(=CC=C3)Cl)NC(=O)C4=CC=CC=C4[N+](=O)[O-] |
Product Overview
F0561-0445 (CAS 1007195-24-5), with molecular formula C18H13ClN4O4S and molecular weight 416.03 g/mol. IUPAC: N-[2-(3-chlorophenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-nitrobenzamide.
Chemical Property Profile of F0561-0445
Property Insights of F0561-0445
The XLogP value of 3.4485 indicates that F0561-0445 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.13 Ų falls within the moderate polarity range, balancing permeability and solubility for F0561-0445. Following Lipinski's Rule of Five, F0561-0445 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 F0561-0445?
The CAS number of F0561-0445 is 1007195-24-5.
What is the molecular formula of F0561-0445?
The molecular formula of F0561-0445 is C18H13ClN4O4S.
What is the molecular weight of F0561-0445?
The molecular weight of F0561-0445 is 416.03 g/mol.
Where can I buy F0561-0445?
You can request a quote for F0561-0445 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0561-0445?
Yes, KEHONG BIO provides custom synthesis services for F0561-0445 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.