6-(Methylthio)-10H-pyrido(3,2-b)thieno(3,4-e)(1,4)diazepine
TL;DR: 6-(Methylthio)-10H-pyrido(3,2-b)thieno(3,4-e)(1,4)diazepine (CAS 66077-84-7) is a chemical compound with molecular formula C11H9N3S2 and molecular weight 247.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-methylsulfanyl-5-thia-2,9,14-triazatricyclo[8.4.0.03,7]tetradeca-1(10),3,6,8,11,13-hexaene
Also Known As: 6-(Methylthio)-10H-pyridothienodiazepine, 6-(Methylthio)-10H-pyrido(3,2-b)thieno(3,4-e)(1,4)diazepine, 6-(Methylthio)-10H-pyrido[3,2-b]thieno[3,4-e][1,4]diazepine, 6-methylsulfanyl-10H-pyrido[[?]]thieno[[?]][1,4]diazepine, 10H-Pyrido[3,2-b]thieno[3,4-e][1,4]diazepine, 6-(methylthio)-
| Molecular Formula | C11H9N3S2 |
|---|---|
| Molecular Weight | 247.02 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 90.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 247.02379 |
| Heavy Atoms | 16 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 66077-84-7 |
|---|---|
| SMILES | CSC1=NC2=C(NC3=CSC=C31)N=CC=C2 |
| InChIKey | RTWXQALODKIXNT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-(Methylthio)-10H-pyrido(3,2-b)thieno(3,4-e)(1,4)diazepine (CAS 66077-84-7), with molecular formula C11H9N3S2 and molecular weight 247.02 g/mol. IUPAC: 8-methylsulfanyl-5-thia-2,9,14-triazatricyclo[8.4.0.03,7]tetradeca-1(10),3,6,8,11,13-hexaene.
Chemical Property Profile of 6-(Methylthio)-10H-pyrido(3,2-b)thieno(3,4-e)(1,4)diazepine
Property Insights of 6-(Methylthio)-10H-pyrido(3,2-b)thieno(3,4-e)(1,4)diazepine
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(Methylthio)-10H-pyrido(3,2-b)thieno(3,4-e)(1,4)diazepine. The TPSA of 90.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(Methylthio)-10H-pyrido(3,2-b)thieno(3,4-e)(1,4)diazepine. Following Lipinski's Rule of Five, 6-(Methylthio)-10H-pyrido(3,2-b)thieno(3,4-e)(1,4)diazepine has 1 hydrogen bond donor(s) and 5 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 6-(Methylthio)-10H-pyrido(3,2-b)thieno(3,4-e)(1,4)diazepine?
The CAS number of 6-(Methylthio)-10H-pyrido(3,2-b)thieno(3,4-e)(1,4)diazepine is 66077-84-7.
What is the molecular formula of 6-(Methylthio)-10H-pyrido(3,2-b)thieno(3,4-e)(1,4)diazepine?
The molecular formula of 6-(Methylthio)-10H-pyrido(3,2-b)thieno(3,4-e)(1,4)diazepine is C11H9N3S2.
What is the molecular weight of 6-(Methylthio)-10H-pyrido(3,2-b)thieno(3,4-e)(1,4)diazepine?
The molecular weight of 6-(Methylthio)-10H-pyrido(3,2-b)thieno(3,4-e)(1,4)diazepine is 247.02 g/mol.
Where can I buy 6-(Methylthio)-10H-pyrido(3,2-b)thieno(3,4-e)(1,4)diazepine?
You can request a quote for 6-(Methylthio)-10H-pyrido(3,2-b)thieno(3,4-e)(1,4)diazepine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(Methylthio)-10H-pyrido(3,2-b)thieno(3,4-e)(1,4)diazepine?
Yes, KEHONG BIO provides custom synthesis services for 6-(Methylthio)-10H-pyrido(3,2-b)thieno(3,4-e)(1,4)diazepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.