F0541-0314
TL;DR: F0541-0314 (CAS 449787-06-8) is a chemical compound with molecular formula C17H14BrN3O4S and molecular weight 434.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-N-[2-(4-methylphenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]furan-2-carboxamide
Also Known As: F0541-0314, 5-bromo-N-(5,5-dioxido-2-(p-tolyl)-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)furan-2-carboxamide, 5-bromo-N-[2-(4-methylphenyl)-5,5-dioxido-2,6-dihydro-4H-thieno[3,4-c]pyrazol-3-yl]-2-furamide, 5-bromo-N-[2-(4-methylphenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]furan-2-carboxamide
| Molecular Formula | C17H14BrN3O4S |
|---|---|
| Molecular Weight | 434.99 g/mol |
| LogP | 3.21692 |
| Topological Polar Surface Area | 94.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 434.98883 |
| Heavy Atoms | 26 |
| Complexity | 1113.587 |
Chemical Identifiers
| CAS Number | 449787-06-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=C3CS(=O)(=O)CC3=N2)NC(=O)C4=CC=C(O4)Br |
Product Overview
F0541-0314 (CAS 449787-06-8), with molecular formula C17H14BrN3O4S and molecular weight 434.99 g/mol. IUPAC: 5-bromo-N-[2-(4-methylphenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]furan-2-carboxamide.
Chemical Property Profile of F0541-0314
Property Insights of F0541-0314
The XLogP value of 3.21692 indicates that F0541-0314 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.2 Ų falls within the moderate polarity range, balancing permeability and solubility for F0541-0314. Following Lipinski's Rule of Five, F0541-0314 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 F0541-0314?
The CAS number of F0541-0314 is 449787-06-8.
What is the molecular formula of F0541-0314?
The molecular formula of F0541-0314 is C17H14BrN3O4S.
What is the molecular weight of F0541-0314?
The molecular weight of F0541-0314 is 434.99 g/mol.
Where can I buy F0541-0314?
You can request a quote for F0541-0314 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0541-0314?
Yes, KEHONG BIO provides custom synthesis services for F0541-0314 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.