![2-[(4-Fluorophenyl)methyl]-2H-[1,2,4]triazino[3,4-b]benzothiazole-3,4-dione structure](/static/products/7247/724704-94-3.webp)
2-[(4-Fluorophenyl)methyl]-2H-[1,2,4]triazino[3,4-b]benzothiazole-3,4-dione
TL;DR: 2-[(4-Fluorophenyl)methyl]-2H-[1,2,4]triazino[3,4-b]benzothiazole-3,4-dione (CAS 724704-94-3) is a chemical compound with molecular formula C16H10FN3O2S and molecular weight 327.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-fluorophenyl)methyl]-[1,2,4]triazino[3,4-b][1,3]benzothiazole-3,4-dione
Also Known As: Maybridge4_001774, AO-476/43380623, 2-(4-fluorobenzyl)-2H-[1,2,4]triazino[3,4-b][1,3]benzothiazole-3,4-dione, 2-[(4-Fluorophenyl)methyl]-2H-[1,2,4]triazino[3,4-b]benzothiazole-3,4-dione, BRD-K35836688-001-01-8
| Molecular Formula | C16H10FN3O2S |
|---|---|
| Molecular Weight | 327.05 g/mol |
| LogP | 2.2583 |
| Topological Polar Surface Area | 56.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 327.0478 |
| Heavy Atoms | 23 |
| Complexity | 1142.1227 |
Chemical Identifiers
| CAS Number | 724704-94-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N3C(=O)C(=O)N(N=C3S2)CC4=CC=C(C=C4)F |
Product Overview
2-[(4-Fluorophenyl)methyl]-2H-[1,2,4]triazino[3,4-b]benzothiazole-3,4-dione (CAS 724704-94-3), with molecular formula C16H10FN3O2S and molecular weight 327.05 g/mol. IUPAC: 2-[(4-fluorophenyl)methyl]-[1,2,4]triazino[3,4-b][1,3]benzothiazole-3,4-dione.
Chemical Property Profile of 2-[(4-Fluorophenyl)methyl]-2H-[1,2,4]triazino[3,4-b]benzothiazole-3,4-dione
Property Insights of 2-[(4-Fluorophenyl)methyl]-2H-[1,2,4]triazino[3,4-b]benzothiazole-3,4-dione
The XLogP value of 2.2583 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(4-Fluorophenyl)methyl]-2H-[1,2,4]triazino[3,4-b]benzothiazole-3,4-dione. With a topological polar surface area (TPSA) of 56.37 Ų, 2-[(4-Fluorophenyl)methyl]-2H-[1,2,4]triazino[3,4-b]benzothiazole-3,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(4-Fluorophenyl)methyl]-2H-[1,2,4]triazino[3,4-b]benzothiazole-3,4-dione has 0 hydrogen bond donor(s) and 4 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-Fluorophenyl)methyl]-2H-[1,2,4]triazino[3,4-b]benzothiazole-3,4-dione?
The CAS number of 2-[(4-Fluorophenyl)methyl]-2H-[1,2,4]triazino[3,4-b]benzothiazole-3,4-dione is 724704-94-3.
What is the molecular formula of 2-[(4-Fluorophenyl)methyl]-2H-[1,2,4]triazino[3,4-b]benzothiazole-3,4-dione?
The molecular formula of 2-[(4-Fluorophenyl)methyl]-2H-[1,2,4]triazino[3,4-b]benzothiazole-3,4-dione is C16H10FN3O2S.
What is the molecular weight of 2-[(4-Fluorophenyl)methyl]-2H-[1,2,4]triazino[3,4-b]benzothiazole-3,4-dione?
The molecular weight of 2-[(4-Fluorophenyl)methyl]-2H-[1,2,4]triazino[3,4-b]benzothiazole-3,4-dione is 327.05 g/mol.
Where can I buy 2-[(4-Fluorophenyl)methyl]-2H-[1,2,4]triazino[3,4-b]benzothiazole-3,4-dione?
You can request a quote for 2-[(4-Fluorophenyl)methyl]-2H-[1,2,4]triazino[3,4-b]benzothiazole-3,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-Fluorophenyl)methyl]-2H-[1,2,4]triazino[3,4-b]benzothiazole-3,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-Fluorophenyl)methyl]-2H-[1,2,4]triazino[3,4-b]benzothiazole-3,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.