5L-346S
TL;DR: 5L-346S (CAS 338960-58-0) is a chemical compound with molecular formula C22H23ClN2O2S2 and molecular weight 446.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-tert-butylphenyl)sulfanyl-6-[(4-chlorophenyl)sulfonylmethyl]-2-methylpyrimidine
Also Known As: 5L-346S, (6-((4-(Tert-butyl)phenyl)sulfanyl)-2-methyl-4-pyrimidinyl)methyl 4-chlorophenyl sulfone, 4-(4-tert-butylphenyl)sulfanyl-6-[(4-chlorophenyl)sulfonylmethyl]-2-methylpyrimidine, 4-[(4-tert-butylphenyl)sulfanyl]-6-[(4-chlorobenzenesulfonyl)methyl]-2-methylpyrimidine, 4-[(4-chlorophenyl)sulfonylmethyl]-2-methyl-6-(4-tert-butylphenyl)sulfanyl-pyrimidine
| Molecular Formula | C22H23ClN2O2S2 |
|---|---|
| Molecular Weight | 446.09 g/mol |
| LogP | 5.86102 |
| Topological Polar Surface Area | 59.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 446.08896 |
| Heavy Atoms | 29 |
| Complexity | 1105.0443 |
Chemical Identifiers
| CAS Number | 338960-58-0 |
|---|---|
| SMILES | CC1=NC(=CC(=N1)SC2=CC=C(C=C2)C(C)(C)C)CS(=O)(=O)C3=CC=C(C=C3)Cl |
Product Overview
5L-346S (CAS 338960-58-0), with molecular formula C22H23ClN2O2S2 and molecular weight 446.09 g/mol. IUPAC: 4-(4-tert-butylphenyl)sulfanyl-6-[(4-chlorophenyl)sulfonylmethyl]-2-methylpyrimidine.
Chemical Property Profile of 5L-346S
Property Insights of 5L-346S
The XLogP value of 5.86102 indicates that 5L-346S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.92 Ų, 5L-346S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5L-346S has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5L-346S?
The CAS number of 5L-346S is 338960-58-0.
What is the molecular formula of 5L-346S?
The molecular formula of 5L-346S is C22H23ClN2O2S2.
What is the molecular weight of 5L-346S?
The molecular weight of 5L-346S is 446.09 g/mol.
Where can I buy 5L-346S?
You can request a quote for 5L-346S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5L-346S?
Yes, KEHONG BIO provides custom synthesis services for 5L-346S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.