4N-326S
TL;DR: 4N-326S (CAS 338749-54-5) is a chemical compound with molecular formula C20H18F3NO3S and molecular weight 409.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-methyl-5-(4-methylsulfonylphenyl)-1-[3-(trifluoromethyl)phenyl]pyrrol-3-yl]methanol
Also Known As: 4N-326S, {2-methyl-5-[4-(methylsulfonyl)phenyl]-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl}methanol, [5-(4-methanesulfonylphenyl)-2-methyl-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl]methanol, [2-methyl-5-(4-methylsulfonylphenyl)-1-[3-(trifluoromethyl)phenyl]pyrrol-3-yl]methanol, [5-(4-methanesulfonylphenyl)-2-methyl-1-[3-(trifluoromethyl)phenyl]pyrrol-3-yl]methanol
| Molecular Formula | C20H18F3NO3S |
|---|---|
| Molecular Weight | 409.10 g/mol |
| LogP | 4.36732 |
| Topological Polar Surface Area | 59.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 409.09595 |
| Heavy Atoms | 28 |
| Complexity | 1114.5879 |
Chemical Identifiers
| CAS Number | 338749-54-5 |
|---|---|
| SMILES | CC1=C(C=C(N1C2=CC=CC(=C2)C(F)(F)F)C3=CC=C(C=C3)S(=O)(=O)C)CO |
Product Overview
4N-326S (CAS 338749-54-5), with molecular formula C20H18F3NO3S and molecular weight 409.10 g/mol. IUPAC: [2-methyl-5-(4-methylsulfonylphenyl)-1-[3-(trifluoromethyl)phenyl]pyrrol-3-yl]methanol.
Chemical Property Profile of 4N-326S
Property Insights of 4N-326S
The XLogP value of 4.36732 indicates that 4N-326S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.3 Ų, 4N-326S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4N-326S has 1 hydrogen bond donor(s) and 3 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 4N-326S?
The CAS number of 4N-326S is 338749-54-5.
What is the molecular formula of 4N-326S?
The molecular formula of 4N-326S is C20H18F3NO3S.
What is the molecular weight of 4N-326S?
The molecular weight of 4N-326S is 409.10 g/mol.
Where can I buy 4N-326S?
You can request a quote for 4N-326S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4N-326S?
Yes, KEHONG BIO provides custom synthesis services for 4N-326S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.