F0605-0594
TL;DR: F0605-0594 (CAS 851094-26-3) is a chemical compound with molecular formula C25H21N3O6S and molecular weight 491.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(benzenesulfonyl)-1-(2,4-dimethylphenyl)-3-methylpyrazol-5-yl] 2-nitrobenzoate
Also Known As: F0605-0594, 1-(2,4-dimethylphenyl)-3-methyl-4-(phenylsulfonyl)-1H-pyrazol-5-yl 2-nitrobenzoate, 4-(benzenesulfonyl)-1-(2,4-dimethylphenyl)-3-methyl-1H-pyrazol-5-yl 2-nitrobenzoate, [4-(benzenesulfonyl)-2-(2,4-dimethylphenyl)-5-methylpyrazol-3-yl] 2-nitrobenzoate, [4-(benzenesulfonyl)-2-(2,4-dimethylphenyl)-5-methyl-pyrazol-3-yl] 2-nitrobenzoate
| Molecular Formula | C25H21N3O6S |
|---|---|
| Molecular Weight | 491.12 g/mol |
| LogP | 4.75776 |
| Topological Polar Surface Area | 121.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 491.1151 |
| Heavy Atoms | 35 |
| Complexity | 1559.5756 |
Chemical Identifiers
| CAS Number | 851094-26-3 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N2C(=C(C(=N2)C)S(=O)(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4[N+](=O)[O-])C |
Product Overview
F0605-0594 (CAS 851094-26-3), with molecular formula C25H21N3O6S and molecular weight 491.12 g/mol. IUPAC: [4-(benzenesulfonyl)-1-(2,4-dimethylphenyl)-3-methylpyrazol-5-yl] 2-nitrobenzoate.
Chemical Property Profile of F0605-0594
Property Insights of F0605-0594
The XLogP value of 4.75776 indicates that F0605-0594 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.4 Ų falls within the moderate polarity range, balancing permeability and solubility for F0605-0594. Following Lipinski's Rule of Five, F0605-0594 has 0 hydrogen bond donor(s) and 7 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 F0605-0594?
The CAS number of F0605-0594 is 851094-26-3.
What is the molecular formula of F0605-0594?
The molecular formula of F0605-0594 is C25H21N3O6S.
What is the molecular weight of F0605-0594?
The molecular weight of F0605-0594 is 491.12 g/mol.
Where can I buy F0605-0594?
You can request a quote for F0605-0594 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0605-0594?
Yes, KEHONG BIO provides custom synthesis services for F0605-0594 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.