3F-323S
TL;DR: 3F-323S (CAS 321553-26-8) is a chemical compound with molecular formula C20H15F6N3OS and molecular weight 459.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-5-(4-methylphenyl)sulfanyl-3-(trifluoromethyl)-N-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide
Also Known As: 3F-323S, 1-methyl-5-[(4-methylphenyl)sulfanyl]-3-(trifluoromethyl)-N-[3-(trifluoromethyl)phenyl]-1H-pyrazole-4-carboxamide, 1-methyl-5-(4-methylphenyl)sulfanyl-3-(trifluoromethyl)-N-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide, 1H-Pyrazole-4-carboxamide, 1-methyl-5-[(4-methylphenyl)thio]-3-(trifluoromethyl)-N-[3-(trifluoromethyl)phenyl]-
| Molecular Formula | C20H15F6N3OS |
|---|---|
| Molecular Weight | 459.08 g/mol |
| LogP | 6.16962 |
| Topological Polar Surface Area | 46.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 459.084 |
| Heavy Atoms | 31 |
| Complexity | 1103.5835 |
Chemical Identifiers
| CAS Number | 321553-26-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SC2=C(C(=NN2C)C(F)(F)F)C(=O)NC3=CC=CC(=C3)C(F)(F)F |
Product Overview
3F-323S (CAS 321553-26-8), with molecular formula C20H15F6N3OS and molecular weight 459.08 g/mol. IUPAC: 1-methyl-5-(4-methylphenyl)sulfanyl-3-(trifluoromethyl)-N-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide.
Chemical Property Profile of 3F-323S
Property Insights of 3F-323S
The XLogP value of 6.16962 indicates that 3F-323S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.92 Ų, 3F-323S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3F-323S has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3F-323S?
The CAS number of 3F-323S is 321553-26-8.
What is the molecular formula of 3F-323S?
The molecular formula of 3F-323S is C20H15F6N3OS.
What is the molecular weight of 3F-323S?
The molecular weight of 3F-323S is 459.08 g/mol.
Where can I buy 3F-323S?
You can request a quote for 3F-323S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3F-323S?
Yes, KEHONG BIO provides custom synthesis services for 3F-323S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.