F0541-0408
TL;DR: F0541-0408 (CAS 449789-02-0) is a chemical compound with molecular formula C22H24ClN3O3S and molecular weight 445.12 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]adamantane-1-carboxamide
Also Known As: F0541-0408, N-[2-(3-chlorophenyl)-5,5-dioxo-2H,4H,6H-5lambda6-thieno[3,4-c]pyrazol-3-yl]adamantane-1-carboxamide, N-[2-(3-chlorophenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]adamantane-1-carboxamide, (3r,5r,7r)-N-(2-(3-chlorophenyl)-5,5-dioxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)adamantane-1-carboxamide, N-[2-(3-CHLOROPHENYL)-5,5-DIOXIDO-2,6-DIHYDRO-4H-THIENO[3,4-C]PYRAZOL-3-YL]-1-ADAMANTANECARBOXAMIDE
| Molecular Formula | C22H24ClN3O3S |
|---|---|
| Molecular Weight | 445.12 g/mol |
| LogP | 4.109 |
| Topological Polar Surface Area | 81.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 445.12268 |
| Heavy Atoms | 30 |
| Complexity | 1135.0013 |
Chemical Identifiers
| CAS Number | 449789-02-0 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)C(=O)NC4=C5CS(=O)(=O)CC5=NN4C6=CC(=CC=C6)Cl |
Product Overview
F0541-0408 (CAS 449789-02-0), with molecular formula C22H24ClN3O3S and molecular weight 445.12 g/mol. IUPAC: N-[2-(3-chlorophenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]adamantane-1-carboxamide.
Chemical Property Profile of F0541-0408
Property Insights of F0541-0408
The XLogP value of 4.109 indicates that F0541-0408 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.06 Ų falls within the moderate polarity range, balancing permeability and solubility for F0541-0408. Following Lipinski's Rule of Five, F0541-0408 has 1 hydrogen bond donor(s) and 4 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 F0541-0408?
The CAS number of F0541-0408 is 449789-02-0.
What is the molecular formula of F0541-0408?
The molecular formula of F0541-0408 is C22H24ClN3O3S.
What is the molecular weight of F0541-0408?
The molecular weight of F0541-0408 is 445.12 g/mol.
Where can I buy F0541-0408?
You can request a quote for F0541-0408 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0541-0408?
Yes, KEHONG BIO provides custom synthesis services for F0541-0408 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.