4H-1,2,4-Benzothiadiazine, 3-(2,3-dihydro-3,3,5-trimethyl-1H-pyrazol-1-yl)-4-ethyl-, S,S-dioxide
TL;DR: 4H-1,2,4-Benzothiadiazine, 3-(2,3-dihydro-3,3,5-trimethyl-1H-pyrazol-1-yl)-4-ethyl-, S,S-dioxide (CAS 107089-89-4) is a chemical compound with molecular formula C15H20N4O2S and molecular weight 320.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethyl-3-(3,5,5-trimethyl-1H-pyrazol-2-yl)-1λ6,2,4-benzothiadiazine 1,1-dioxide
Also Known As: 4H-1,2,4-Benzothiadiazine, 3-(2,3-dihydro-3,3,5-trimethyl-1H-pyrazol-1-yl)-4-ethyl-, S,S-dioxide, 4-ethyl-3-(3,5,5-trimethyl-1H-pyrazol-2-yl)-1, 4-Ethyl-3-(3,3,5-trimethyl-2,3-dihydro-1H-pyrazol-1-yl)-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione, RefChem:296894
| Molecular Formula | C15H20N4O2S |
|---|---|
| Molecular Weight | 320.13 g/mol |
| LogP | 2.0738 |
| Topological Polar Surface Area | 65.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 320.1307 |
| Heavy Atoms | 22 |
| Complexity | 780.4871 |
Chemical Identifiers
| CAS Number | 107089-89-4 |
|---|---|
| SMILES | CCN1C2=CC=CC=C2S(=O)(=O)N=C1N3C(=CC(N3)(C)C)C |
Product Overview
4H-1,2,4-Benzothiadiazine, 3-(2,3-dihydro-3,3,5-trimethyl-1H-pyrazol-1-yl)-4-ethyl-, S,S-dioxide (CAS 107089-89-4), with molecular formula C15H20N4O2S and molecular weight 320.13 g/mol. IUPAC: 4-ethyl-3-(3,5,5-trimethyl-1H-pyrazol-2-yl)-1λ6,2,4-benzothiadiazine 1,1-dioxide.
Chemical Property Profile of 4H-1,2,4-Benzothiadiazine, 3-(2,3-dihydro-3,3,5-trimethyl-1H-pyrazol-1-yl)-4-ethyl-, S,S-dioxide
Property Insights of 4H-1,2,4-Benzothiadiazine, 3-(2,3-dihydro-3,3,5-trimethyl-1H-pyrazol-1-yl)-4-ethyl-, S,S-dioxide
The XLogP value of 2.0738 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H-1,2,4-Benzothiadiazine, 3-(2,3-dihydro-3,3,5-trimethyl-1H-pyrazol-1-yl)-4-ethyl-, S,S-dioxide. The TPSA of 65.01 Ų falls within the moderate polarity range, balancing permeability and solubility for 4H-1,2,4-Benzothiadiazine, 3-(2,3-dihydro-3,3,5-trimethyl-1H-pyrazol-1-yl)-4-ethyl-, S,S-dioxide. Following Lipinski's Rule of Five, 4H-1,2,4-Benzothiadiazine, 3-(2,3-dihydro-3,3,5-trimethyl-1H-pyrazol-1-yl)-4-ethyl-, S,S-dioxide 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 4H-1,2,4-Benzothiadiazine, 3-(2,3-dihydro-3,3,5-trimethyl-1H-pyrazol-1-yl)-4-ethyl-, S,S-dioxide?
The CAS number of 4H-1,2,4-Benzothiadiazine, 3-(2,3-dihydro-3,3,5-trimethyl-1H-pyrazol-1-yl)-4-ethyl-, S,S-dioxide is 107089-89-4.
What is the molecular formula of 4H-1,2,4-Benzothiadiazine, 3-(2,3-dihydro-3,3,5-trimethyl-1H-pyrazol-1-yl)-4-ethyl-, S,S-dioxide?
The molecular formula of 4H-1,2,4-Benzothiadiazine, 3-(2,3-dihydro-3,3,5-trimethyl-1H-pyrazol-1-yl)-4-ethyl-, S,S-dioxide is C15H20N4O2S.
What is the molecular weight of 4H-1,2,4-Benzothiadiazine, 3-(2,3-dihydro-3,3,5-trimethyl-1H-pyrazol-1-yl)-4-ethyl-, S,S-dioxide?
The molecular weight of 4H-1,2,4-Benzothiadiazine, 3-(2,3-dihydro-3,3,5-trimethyl-1H-pyrazol-1-yl)-4-ethyl-, S,S-dioxide is 320.13 g/mol.
Where can I buy 4H-1,2,4-Benzothiadiazine, 3-(2,3-dihydro-3,3,5-trimethyl-1H-pyrazol-1-yl)-4-ethyl-, S,S-dioxide?
You can request a quote for 4H-1,2,4-Benzothiadiazine, 3-(2,3-dihydro-3,3,5-trimethyl-1H-pyrazol-1-yl)-4-ethyl-, S,S-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-1,2,4-Benzothiadiazine, 3-(2,3-dihydro-3,3,5-trimethyl-1H-pyrazol-1-yl)-4-ethyl-, S,S-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 4H-1,2,4-Benzothiadiazine, 3-(2,3-dihydro-3,3,5-trimethyl-1H-pyrazol-1-yl)-4-ethyl-, S,S-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.