4L-541S
TL;DR: 4L-541S (CAS 318248-71-4) is a chemical compound with molecular formula C19H18Cl2N2S2 and molecular weight 408.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-4-[(2-chlorophenyl)sulfanylmethyl]-1-methyl-3-[(4-methylphenyl)sulfanylmethyl]pyrazole
Also Known As: 4L-541S, 5-chloro-4-[(2-chlorophenyl)sulfanylmethyl]-1-methyl-3-[(4-methylphenyl)sulfanylmethyl]pyrazole, (5-chloro-4-{[(2-chlorophenyl)sulfanyl]methyl}-1-methyl-1H-pyrazol-3-yl)methyl 4-methylphenyl sulfide, 5-chloro-4-{[(2-chlorophenyl)sulfanyl]methyl}-1-methyl-3-{[(4-methylphenyl)sulfanyl]methyl}-1H-pyrazole
| Molecular Formula | C19H18Cl2N2S2 |
|---|---|
| Molecular Weight | 408.03 g/mol |
| LogP | 6.61992 |
| Topological Polar Surface Area | 17.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 408.02884 |
| Heavy Atoms | 25 |
| Complexity | 860.3607 |
Chemical Identifiers
| CAS Number | 318248-71-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SCC2=NN(C(=C2CSC3=CC=CC=C3Cl)Cl)C |
Product Overview
4L-541S (CAS 318248-71-4), with molecular formula C19H18Cl2N2S2 and molecular weight 408.03 g/mol. IUPAC: 5-chloro-4-[(2-chlorophenyl)sulfanylmethyl]-1-methyl-3-[(4-methylphenyl)sulfanylmethyl]pyrazole.
Chemical Property Profile of 4L-541S
Property Insights of 4L-541S
The XLogP value of 6.61992 indicates that 4L-541S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.82 Ų, 4L-541S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4L-541S has 0 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 4L-541S?
The CAS number of 4L-541S is 318248-71-4.
What is the molecular formula of 4L-541S?
The molecular formula of 4L-541S is C19H18Cl2N2S2.
What is the molecular weight of 4L-541S?
The molecular weight of 4L-541S is 408.03 g/mol.
Where can I buy 4L-541S?
You can request a quote for 4L-541S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4L-541S?
Yes, KEHONG BIO provides custom synthesis services for 4L-541S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.