triazolothiadiazine, 33
TL;DR: triazolothiadiazine, 33 (CAS 579441-23-9) is a chemical compound with molecular formula C18H15FN4O2S and molecular weight 370.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3,4-dimethoxyphenyl)-3-(2-fluorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Also Known As: triazolothiadiazine, 33, BRD-K49972769-001-01-7, 6-(3,4-dimethoxyphenyl)-3-(2-fluorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine, 4-[3-(2-fluorophenyl)(7H-1,2,4-triazolo[3,4-b]1,3,4-thiadiazin-6-yl)]-1,2-dime thoxybenzene
| Molecular Formula | C18H15FN4O2S |
|---|---|
| Molecular Weight | 370.09 g/mol |
| LogP | 3.4595 |
| Topological Polar Surface Area | 61.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 370.08997 |
| Heavy Atoms | 26 |
| Complexity | 1002.6062 |
Chemical Identifiers
| CAS Number | 579441-23-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=NN3C(=NN=C3SC2)C4=CC=CC=C4F)OC |
Product Overview
triazolothiadiazine, 33 (CAS 579441-23-9), with molecular formula C18H15FN4O2S and molecular weight 370.09 g/mol. IUPAC: 6-(3,4-dimethoxyphenyl)-3-(2-fluorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine.
Chemical Property Profile of triazolothiadiazine, 33
Property Insights of triazolothiadiazine, 33
The XLogP value of 3.4595 indicates that triazolothiadiazine, 33 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.53 Ų falls within the moderate polarity range, balancing permeability and solubility for triazolothiadiazine, 33. Following Lipinski's Rule of Five, triazolothiadiazine, 33 has 0 hydrogen bond donor(s) and 6 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 triazolothiadiazine, 33?
The CAS number of triazolothiadiazine, 33 is 579441-23-9.
What is the molecular formula of triazolothiadiazine, 33?
The molecular formula of triazolothiadiazine, 33 is C18H15FN4O2S.
What is the molecular weight of triazolothiadiazine, 33?
The molecular weight of triazolothiadiazine, 33 is 370.09 g/mol.
Where can I buy triazolothiadiazine, 33?
You can request a quote for triazolothiadiazine, 33 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for triazolothiadiazine, 33?
Yes, KEHONG BIO provides custom synthesis services for triazolothiadiazine, 33 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.