BAS 02824814
TL;DR: BAS 02824814 (CAS 333741-53-0) is a chemical compound with molecular formula C21H23ClN4O4S and molecular weight 462.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-chloro-2-methyl-N-methylsulfonylanilino)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)acetamide
Also Known As: BAS 02824814, AB01293621-01, N~2~-(3-chloro-2-methylphenyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-N~2~-(methylsulfonyl)glycinamide, 2-(3-chloro-2-methyl-N-methylsulfonylanilino)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)acetamide
| Molecular Formula | C21H23ClN4O4S |
|---|---|
| Molecular Weight | 462.11 g/mol |
| LogP | 2.85094 |
| Topological Polar Surface Area | 93.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 462.11285 |
| Heavy Atoms | 31 |
| Complexity | 1296.9042 |
Chemical Identifiers
| CAS Number | 333741-53-0 |
|---|---|
| SMILES | CC1=C(C=CC=C1Cl)N(CC(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)S(=O)(=O)C |
Product Overview
BAS 02824814 (CAS 333741-53-0), with molecular formula C21H23ClN4O4S and molecular weight 462.11 g/mol. IUPAC: 2-(3-chloro-2-methyl-N-methylsulfonylanilino)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)acetamide.
Chemical Property Profile of BAS 02824814
Property Insights of BAS 02824814
The XLogP value of 2.85094 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 02824814. The TPSA of 93.41 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02824814. Following Lipinski's Rule of Five, BAS 02824814 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 BAS 02824814?
The CAS number of BAS 02824814 is 333741-53-0.
What is the molecular formula of BAS 02824814?
The molecular formula of BAS 02824814 is C21H23ClN4O4S.
What is the molecular weight of BAS 02824814?
The molecular weight of BAS 02824814 is 462.11 g/mol.
Where can I buy BAS 02824814?
You can request a quote for BAS 02824814 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02824814?
Yes, KEHONG BIO provides custom synthesis services for BAS 02824814 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.