![9-[(2-Chlorobenzyl)sulfanyl]acenaphtho[1,2-e][1,2,4]triazine structure](/static/products/3781/378196-39-5.webp)
9-[(2-Chlorobenzyl)sulfanyl]acenaphtho[1,2-e][1,2,4]triazine
TL;DR: 9-[(2-Chlorobenzyl)sulfanyl]acenaphtho[1,2-e][1,2,4]triazine (CAS 378196-39-5) is a chemical compound with molecular formula C20H12ClN3S and molecular weight 361.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-[(2-chlorophenyl)methylsulfanyl]-11,12,14-triazatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5(16),6,8,10(15),11,13-octaene
Also Known As: ChemDiv1_024159, 9-[(2-chlorobenzyl)sulfanyl]acenaphtho[1,2-e][1,2,4]triazine, 9-((2-chlorobenzyl)thio)acenaphtho[1,2-e][1,2,4]triazine, AM-760/15239035, 13-[(2-chlorophenyl)methylsulfanyl]-11,12,14-triazatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5(16),6,8,10(15),11,13-octaene
| Molecular Formula | C20H12ClN3S |
|---|---|
| Molecular Weight | 361.04 g/mol |
| LogP | 5.6179 |
| Topological Polar Surface Area | 38.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 361.04404 |
| Heavy Atoms | 25 |
| Complexity | 1121.6503 |
Chemical Identifiers
| CAS Number | 378196-39-5 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CSC2=NC3=C(C4=CC=CC5=C4C3=CC=C5)N=N2)Cl |
Product Overview
9-[(2-Chlorobenzyl)sulfanyl]acenaphtho[1,2-e][1,2,4]triazine (CAS 378196-39-5), with molecular formula C20H12ClN3S and molecular weight 361.04 g/mol. IUPAC: 13-[(2-chlorophenyl)methylsulfanyl]-11,12,14-triazatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5(16),6,8,10(15),11,13-octaene.
Chemical Property Profile of 9-[(2-Chlorobenzyl)sulfanyl]acenaphtho[1,2-e][1,2,4]triazine
Property Insights of 9-[(2-Chlorobenzyl)sulfanyl]acenaphtho[1,2-e][1,2,4]triazine
The XLogP value of 5.6179 indicates that 9-[(2-Chlorobenzyl)sulfanyl]acenaphtho[1,2-e][1,2,4]triazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.67 Ų, 9-[(2-Chlorobenzyl)sulfanyl]acenaphtho[1,2-e][1,2,4]triazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-[(2-Chlorobenzyl)sulfanyl]acenaphtho[1,2-e][1,2,4]triazine has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9-[(2-Chlorobenzyl)sulfanyl]acenaphtho[1,2-e][1,2,4]triazine?
The CAS number of 9-[(2-Chlorobenzyl)sulfanyl]acenaphtho[1,2-e][1,2,4]triazine is 378196-39-5.
What is the molecular formula of 9-[(2-Chlorobenzyl)sulfanyl]acenaphtho[1,2-e][1,2,4]triazine?
The molecular formula of 9-[(2-Chlorobenzyl)sulfanyl]acenaphtho[1,2-e][1,2,4]triazine is C20H12ClN3S.
What is the molecular weight of 9-[(2-Chlorobenzyl)sulfanyl]acenaphtho[1,2-e][1,2,4]triazine?
The molecular weight of 9-[(2-Chlorobenzyl)sulfanyl]acenaphtho[1,2-e][1,2,4]triazine is 361.04 g/mol.
Where can I buy 9-[(2-Chlorobenzyl)sulfanyl]acenaphtho[1,2-e][1,2,4]triazine?
You can request a quote for 9-[(2-Chlorobenzyl)sulfanyl]acenaphtho[1,2-e][1,2,4]triazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-[(2-Chlorobenzyl)sulfanyl]acenaphtho[1,2-e][1,2,4]triazine?
Yes, KEHONG BIO provides custom synthesis services for 9-[(2-Chlorobenzyl)sulfanyl]acenaphtho[1,2-e][1,2,4]triazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.