4H-s-Triazolo(3,4-c)(1,4)benzothiazine, 1-methyl-8-(trifluoromethyl)-
TL;DR: 4H-s-Triazolo(3,4-c)(1,4)benzothiazine, 1-methyl-8-(trifluoromethyl)- (CAS 99286-72-3) is a chemical compound with molecular formula C11H8F3N3S and molecular weight 271.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-8-(trifluoromethyl)-4H-[1,2,4]triazolo[3,4-c][1,4]benzothiazine
Also Known As: 4H-s-Triazolo(3,4-c)(1,4)benzothiazine, 1-methyl-8-(trifluoromethyl)-, 1-Methyl-8-(trifluoromethyl)-4H-s-triazolo(3,4-c)(1,4)benzothiazine, 1-methyl-8-(trifluoromethyl)-4H-[1,2,4]triazolo[3,4-c][1,4]benzothiazine, RefChem:297910
| Molecular Formula | C11H8F3N3S |
|---|---|
| Molecular Weight | 271.04 g/mol |
| LogP | 3.20022 |
| Topological Polar Surface Area | 30.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 271.0391 |
| Heavy Atoms | 18 |
| Complexity | 618.4814 |
Chemical Identifiers
| CAS Number | 99286-72-3 |
|---|---|
| SMILES | CC1=NN=C2N1C3=C(C=CC(=C3)C(F)(F)F)SC2 |
Product Overview
4H-s-Triazolo(3,4-c)(1,4)benzothiazine, 1-methyl-8-(trifluoromethyl)- (CAS 99286-72-3), with molecular formula C11H8F3N3S and molecular weight 271.04 g/mol. IUPAC: 1-methyl-8-(trifluoromethyl)-4H-[1,2,4]triazolo[3,4-c][1,4]benzothiazine.
Chemical Property Profile of 4H-s-Triazolo(3,4-c)(1,4)benzothiazine, 1-methyl-8-(trifluoromethyl)-
Property Insights of 4H-s-Triazolo(3,4-c)(1,4)benzothiazine, 1-methyl-8-(trifluoromethyl)-
The XLogP value of 3.20022 indicates that 4H-s-Triazolo(3,4-c)(1,4)benzothiazine, 1-methyl-8-(trifluoromethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.71 Ų, 4H-s-Triazolo(3,4-c)(1,4)benzothiazine, 1-methyl-8-(trifluoromethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-s-Triazolo(3,4-c)(1,4)benzothiazine, 1-methyl-8-(trifluoromethyl)- has 0 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 4H-s-Triazolo(3,4-c)(1,4)benzothiazine, 1-methyl-8-(trifluoromethyl)-?
The CAS number of 4H-s-Triazolo(3,4-c)(1,4)benzothiazine, 1-methyl-8-(trifluoromethyl)- is 99286-72-3.
What is the molecular formula of 4H-s-Triazolo(3,4-c)(1,4)benzothiazine, 1-methyl-8-(trifluoromethyl)-?
The molecular formula of 4H-s-Triazolo(3,4-c)(1,4)benzothiazine, 1-methyl-8-(trifluoromethyl)- is C11H8F3N3S.
What is the molecular weight of 4H-s-Triazolo(3,4-c)(1,4)benzothiazine, 1-methyl-8-(trifluoromethyl)-?
The molecular weight of 4H-s-Triazolo(3,4-c)(1,4)benzothiazine, 1-methyl-8-(trifluoromethyl)- is 271.04 g/mol.
Where can I buy 4H-s-Triazolo(3,4-c)(1,4)benzothiazine, 1-methyl-8-(trifluoromethyl)-?
You can request a quote for 4H-s-Triazolo(3,4-c)(1,4)benzothiazine, 1-methyl-8-(trifluoromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-s-Triazolo(3,4-c)(1,4)benzothiazine, 1-methyl-8-(trifluoromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 4H-s-Triazolo(3,4-c)(1,4)benzothiazine, 1-methyl-8-(trifluoromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.