F0561-0538
TL;DR: F0561-0538 (CAS 1020247-33-9) is a chemical compound with molecular formula C21H18F3N3O2S and molecular weight 433.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(2,3-dimethylphenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-3-(trifluoromethyl)benzamide
Also Known As: F0561-0538, N-[2-(2,3-dimethylphenyl)-5-oxo-2H,4H,6H-5lambda4-thieno[3,4-c]pyrazol-3-yl]-3-(trifluoromethyl)benzamide, N-[2-(2,3-dimethylphenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-3-(trifluoromethyl)benzamide, N-(2-(2,3-dimethylphenyl)-5-oxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-3-(trifluoromethyl)benzamide
| Molecular Formula | C21H18F3N3O2S |
|---|---|
| Molecular Weight | 433.11 g/mol |
| LogP | 4.52254 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 433.10718 |
| Heavy Atoms | 30 |
| Complexity | 1184.7251 |
Chemical Identifiers
| CAS Number | 1020247-33-9 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)N2C(=C3CS(=O)CC3=N2)NC(=O)C4=CC(=CC=C4)C(F)(F)F)C |
Product Overview
F0561-0538 (CAS 1020247-33-9), with molecular formula C21H18F3N3O2S and molecular weight 433.11 g/mol. IUPAC: N-[2-(2,3-dimethylphenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-3-(trifluoromethyl)benzamide.
Chemical Property Profile of F0561-0538
Property Insights of F0561-0538
The XLogP value of 4.52254 indicates that F0561-0538 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for F0561-0538. Following Lipinski's Rule of Five, F0561-0538 has 1 hydrogen bond donor(s) and 3 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 F0561-0538?
The CAS number of F0561-0538 is 1020247-33-9.
What is the molecular formula of F0561-0538?
The molecular formula of F0561-0538 is C21H18F3N3O2S.
What is the molecular weight of F0561-0538?
The molecular weight of F0561-0538 is 433.11 g/mol.
Where can I buy F0561-0538?
You can request a quote for F0561-0538 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0561-0538?
Yes, KEHONG BIO provides custom synthesis services for F0561-0538 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.