Isothiazolo(4',5':4,5)thieno(3,2-d)-1,2,3-triazine, 4-chloro-8-(methylthio)-
TL;DR: Isothiazolo(4',5':4,5)thieno(3,2-d)-1,2,3-triazine, 4-chloro-8-(methylthio)- (CAS 135489-07-5) is a chemical compound with molecular formula C7H3ClN4S3 and molecular weight 273.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-chloro-3-methylsulfanyl-5,7-dithia-4,10,11,12-tetrazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),3,9,11-pentaene
Also Known As: Isothiazolo(4',5':4,5)thieno(3,2-d)-1,2,3-triazine, 4-chloro-8-(methylthio)-, 4-Chloro-8-(methylthio)isothiazolo(4',5':4,5)thieno(3,2-d)-1,2,3-triazine, 4-chloro-8-methylsulfanyl-[1,2]thiazolo[2,3]thieno[2,4-b]triazine, 7-Chloro-3-(methylthio)-2,4,5,6-tetraaza-1,8-dithiacyclopent[a]indene, 4-Chloro-8-(methylsulfanyl)[1,2]thiazolo[4',5':4,5]thieno[3,2-d][1,2,3]triazine
| Molecular Formula | C7H3ClN4S3 |
|---|---|
| Molecular Weight | 273.92 g/mol |
| LogP | 3.0713 |
| Topological Polar Surface Area | 51.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 273.92084 |
| Heavy Atoms | 15 |
| Complexity | 646.05835 |
Chemical Identifiers
| CAS Number | 135489-07-5 |
|---|---|
| SMILES | CSC1=NSC2=C1C3=C(S2)C(=NN=N3)Cl |
Product Overview
Isothiazolo(4',5':4,5)thieno(3,2-d)-1,2,3-triazine, 4-chloro-8-(methylthio)- (CAS 135489-07-5), with molecular formula C7H3ClN4S3 and molecular weight 273.92 g/mol. IUPAC: 9-chloro-3-methylsulfanyl-5,7-dithia-4,10,11,12-tetrazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),3,9,11-pentaene.
Chemical Property Profile of Isothiazolo(4',5':4,5)thieno(3,2-d)-1,2,3-triazine, 4-chloro-8-(methylthio)-
Property Insights of Isothiazolo(4',5':4,5)thieno(3,2-d)-1,2,3-triazine, 4-chloro-8-(methylthio)-
The XLogP value of 3.0713 indicates that Isothiazolo(4',5':4,5)thieno(3,2-d)-1,2,3-triazine, 4-chloro-8-(methylthio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.56 Ų, Isothiazolo(4',5':4,5)thieno(3,2-d)-1,2,3-triazine, 4-chloro-8-(methylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isothiazolo(4',5':4,5)thieno(3,2-d)-1,2,3-triazine, 4-chloro-8-(methylthio)- has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Isothiazolo(4',5':4,5)thieno(3,2-d)-1,2,3-triazine, 4-chloro-8-(methylthio)-?
The CAS number of Isothiazolo(4',5':4,5)thieno(3,2-d)-1,2,3-triazine, 4-chloro-8-(methylthio)- is 135489-07-5.
What is the molecular formula of Isothiazolo(4',5':4,5)thieno(3,2-d)-1,2,3-triazine, 4-chloro-8-(methylthio)-?
The molecular formula of Isothiazolo(4',5':4,5)thieno(3,2-d)-1,2,3-triazine, 4-chloro-8-(methylthio)- is C7H3ClN4S3.
What is the molecular weight of Isothiazolo(4',5':4,5)thieno(3,2-d)-1,2,3-triazine, 4-chloro-8-(methylthio)-?
The molecular weight of Isothiazolo(4',5':4,5)thieno(3,2-d)-1,2,3-triazine, 4-chloro-8-(methylthio)- is 273.92 g/mol.
Where can I buy Isothiazolo(4',5':4,5)thieno(3,2-d)-1,2,3-triazine, 4-chloro-8-(methylthio)-?
You can request a quote for Isothiazolo(4',5':4,5)thieno(3,2-d)-1,2,3-triazine, 4-chloro-8-(methylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isothiazolo(4',5':4,5)thieno(3,2-d)-1,2,3-triazine, 4-chloro-8-(methylthio)-?
Yes, KEHONG BIO provides custom synthesis services for Isothiazolo(4',5':4,5)thieno(3,2-d)-1,2,3-triazine, 4-chloro-8-(methylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.