3L-620S
TL;DR: 3L-620S (CAS 318234-41-2) is a chemical compound with molecular formula C18H15Cl2FN2S2 and molecular weight 412.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-3-[(4-chlorophenyl)sulfanylmethyl]-4-[(4-fluorophenyl)sulfanylmethyl]-1-methylpyrazole
Also Known As: 3L-620S, (5-chloro-3-{[(4-chlorophenyl)sulfanyl]methyl}-1-methyl-1H-pyrazol-4-yl)methyl 4-fluorophenyl sulfide, 5-chloro-3-[(4-chlorophenyl)sulfanylmethyl]-4-[(4-fluorophenyl)sulfanylmethyl]-1-methylpyrazole, 5-chloro-3-{[(4-chlorophenyl)sulfanyl]methyl}-4-{[(4-fluorophenyl)sulfanyl]methyl}-1-methyl-1H-pyrazole, 1H-Pyrazole, 5-chloro-3-[[(4-chlorophenyl)thio]methyl]-4-[[(4-fluorophenyl)thio]methyl]-1-methyl-
| Molecular Formula | C18H15Cl2FN2S2 |
|---|---|
| Molecular Weight | 412.00 g/mol |
| LogP | 6.4506 |
| Topological Polar Surface Area | 17.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 412.00378 |
| Heavy Atoms | 25 |
| Complexity | 848.7627 |
Chemical Identifiers
| CAS Number | 318234-41-2 |
|---|---|
| SMILES | CN1C(=C(C(=N1)CSC2=CC=C(C=C2)Cl)CSC3=CC=C(C=C3)F)Cl |
Product Overview
3L-620S (CAS 318234-41-2), with molecular formula C18H15Cl2FN2S2 and molecular weight 412.00 g/mol. IUPAC: 5-chloro-3-[(4-chlorophenyl)sulfanylmethyl]-4-[(4-fluorophenyl)sulfanylmethyl]-1-methylpyrazole.
Chemical Property Profile of 3L-620S
Property Insights of 3L-620S
The XLogP value of 6.4506 indicates that 3L-620S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.82 Ų, 3L-620S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3L-620S 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 3L-620S?
The CAS number of 3L-620S is 318234-41-2.
What is the molecular formula of 3L-620S?
The molecular formula of 3L-620S is C18H15Cl2FN2S2.
What is the molecular weight of 3L-620S?
The molecular weight of 3L-620S is 412.00 g/mol.
Where can I buy 3L-620S?
You can request a quote for 3L-620S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3L-620S?
Yes, KEHONG BIO provides custom synthesis services for 3L-620S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.