2,4-Dihydro-1H-(1,2,4)triazolo(3,4-c)(1,4)benzothiazin-1-one
TL;DR: 2,4-Dihydro-1H-(1,2,4)triazolo(3,4-c)(1,4)benzothiazin-1-one (CAS 6289-04-9) is a chemical compound with molecular formula C9H7N3OS and molecular weight 205.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dihydro-[1,2,4]triazolo[3,4-c][1,4]benzothiazin-1-one
Also Known As: IDPH 791, 2,4-dihydro-1h-[1,2,4]triazolo[3,4-c][1,4]benzothiazin-1-one, 2,4-dihydro-[1,2,4]triazolo[3,4-c][1,4]benzothiazin-1-one, 2,4-Dihydro-1H-(1,2,4)triazolo(3,4-c)(1,4)benzothiazin-1-one, 1-Oxo-2,4-dihydro(1,2,4)triazolo(3,4-c)(1,4)benzothiazine
| Molecular Formula | C9H7N3OS |
|---|---|
| Molecular Weight | 205.03 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 70.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 205.03099 |
| Heavy Atoms | 14 |
| Complexity | 304.0 |
Chemical Identifiers
| CAS Number | 6289-04-9 |
|---|---|
| SMILES | C1C2=NNC(=O)N2C3=CC=CC=C3S1 |
| InChIKey | DEHMKMLLYRNHIJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4-Dihydro-1H-(1,2,4)triazolo(3,4-c)(1,4)benzothiazin-1-one (CAS 6289-04-9), with molecular formula C9H7N3OS and molecular weight 205.03 g/mol. IUPAC: 2,4-dihydro-[1,2,4]triazolo[3,4-c][1,4]benzothiazin-1-one.
Chemical Property Profile of 2,4-Dihydro-1H-(1,2,4)triazolo(3,4-c)(1,4)benzothiazin-1-one
Property Insights of 2,4-Dihydro-1H-(1,2,4)triazolo(3,4-c)(1,4)benzothiazin-1-one
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Dihydro-1H-(1,2,4)triazolo(3,4-c)(1,4)benzothiazin-1-one. The TPSA of 70.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Dihydro-1H-(1,2,4)triazolo(3,4-c)(1,4)benzothiazin-1-one. Following Lipinski's Rule of Five, 2,4-Dihydro-1H-(1,2,4)triazolo(3,4-c)(1,4)benzothiazin-1-one has 1 hydrogen bond donor(s) and 3 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 2,4-Dihydro-1H-(1,2,4)triazolo(3,4-c)(1,4)benzothiazin-1-one?
The CAS number of 2,4-Dihydro-1H-(1,2,4)triazolo(3,4-c)(1,4)benzothiazin-1-one is 6289-04-9.
What is the molecular formula of 2,4-Dihydro-1H-(1,2,4)triazolo(3,4-c)(1,4)benzothiazin-1-one?
The molecular formula of 2,4-Dihydro-1H-(1,2,4)triazolo(3,4-c)(1,4)benzothiazin-1-one is C9H7N3OS.
What is the molecular weight of 2,4-Dihydro-1H-(1,2,4)triazolo(3,4-c)(1,4)benzothiazin-1-one?
The molecular weight of 2,4-Dihydro-1H-(1,2,4)triazolo(3,4-c)(1,4)benzothiazin-1-one is 205.03 g/mol.
Where can I buy 2,4-Dihydro-1H-(1,2,4)triazolo(3,4-c)(1,4)benzothiazin-1-one?
You can request a quote for 2,4-Dihydro-1H-(1,2,4)triazolo(3,4-c)(1,4)benzothiazin-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dihydro-1H-(1,2,4)triazolo(3,4-c)(1,4)benzothiazin-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dihydro-1H-(1,2,4)triazolo(3,4-c)(1,4)benzothiazin-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.