C26H20ClN3S
TL;DR: C26H20ClN3S (CAS 848926-03-4) is a chemical compound with molecular formula C26H20ClN3S and molecular weight 441.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chlorophenyl)-4-(4-methylphenyl)-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole
Also Known As: 3-(2-chlorophenyl)-4-(4-methylphenyl)-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole, 3-(2-chlorophenyl)-5-((naphthalen-1-ylmethyl)thio)-4-(p-tolyl)-4H-1,2,4-triazole, 3-(2-chlorophenyl)-4-(4-methylphenyl)-5-[(naphthalen-1-ylmethyl)sulfanyl]-4H-1,2,4-triazole
| Molecular Formula | C26H20ClN3S |
|---|---|
| Molecular Weight | 441.11 g/mol |
| LogP | 7.34162 |
| Topological Polar Surface Area | 30.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 441.10666 |
| Heavy Atoms | 31 |
| Complexity | 1353.7356 |
Chemical Identifiers
| CAS Number | 848926-03-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC4=CC=CC=C43)C5=CC=CC=C5Cl |
Product Overview
C26H20ClN3S (CAS 848926-03-4), with molecular formula C26H20ClN3S and molecular weight 441.11 g/mol. IUPAC: 3-(2-chlorophenyl)-4-(4-methylphenyl)-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole.
Chemical Property Profile of C26H20ClN3S
Property Insights of C26H20ClN3S
The XLogP value of 7.34162 indicates that C26H20ClN3S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.71 Ų, C26H20ClN3S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C26H20ClN3S 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 C26H20ClN3S?
The CAS number of C26H20ClN3S is 848926-03-4.
What is the molecular formula of C26H20ClN3S?
The molecular formula of C26H20ClN3S is C26H20ClN3S.
What is the molecular weight of C26H20ClN3S?
The molecular weight of C26H20ClN3S is 441.11 g/mol.
Where can I buy C26H20ClN3S?
You can request a quote for C26H20ClN3S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C26H20ClN3S?
Yes, KEHONG BIO provides custom synthesis services for C26H20ClN3S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.