F0541-0459
TL;DR: F0541-0459 (CAS 500266-91-1) is a chemical compound with molecular formula C22H22ClN3O5S and molecular weight 475.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(3-chlorophenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-3,4-diethoxybenzamide
Also Known As: F0541-0459, N-(2-(3-chlorophenyl)-5,5-dioxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-3,4-diethoxybenzamide, N-[2-(3-chlorophenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-3,4-diethoxybenzamide, N-[2-(3-chlorophenyl)-5,5-dioxo-2H,4H,6H-5lambda6-thieno[3,4-c]pyrazol-3-yl]-3,4-diethoxybenzamide, N-[2-(3-chlorophenyl)-5,5-dioxido-2,6-dihydro-4H-thieno[3,4-c]pyrazol-3-yl]-3,4-diethoxybenzamide
| Molecular Formula | C22H22ClN3O5S |
|---|---|
| Molecular Weight | 475.10 g/mol |
| LogP | 4.0038 |
| Topological Polar Surface Area | 99.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 475.09686 |
| Heavy Atoms | 32 |
| Complexity | 1286.7136 |
Chemical Identifiers
| CAS Number | 500266-91-1 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C(=O)NC2=C3CS(=O)(=O)CC3=NN2C4=CC(=CC=C4)Cl)OCC |
Product Overview
F0541-0459 (CAS 500266-91-1), with molecular formula C22H22ClN3O5S and molecular weight 475.10 g/mol. IUPAC: N-[2-(3-chlorophenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-3,4-diethoxybenzamide.
Chemical Property Profile of F0541-0459
Property Insights of F0541-0459
The XLogP value of 4.0038 indicates that F0541-0459 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.52 Ų falls within the moderate polarity range, balancing permeability and solubility for F0541-0459. Following Lipinski's Rule of Five, F0541-0459 has 1 hydrogen bond donor(s) and 6 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 F0541-0459?
The CAS number of F0541-0459 is 500266-91-1.
What is the molecular formula of F0541-0459?
The molecular formula of F0541-0459 is C22H22ClN3O5S.
What is the molecular weight of F0541-0459?
The molecular weight of F0541-0459 is 475.10 g/mol.
Where can I buy F0541-0459?
You can request a quote for F0541-0459 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0541-0459?
Yes, KEHONG BIO provides custom synthesis services for F0541-0459 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.