RefChem:296899
TL;DR: RefChem:296899 (CAS 107089-84-9) is a chemical compound with molecular formula C18H16N4O2S and molecular weight 352.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,5-dimethylpyrazol-1-yl)-4-phenyl-1λ6,2,4-benzothiadiazine 1,1-dioxide
Also Known As: 3-(3,5-dimethylpyrazol-1-yl)-4-phenyl-1, 4H-1,2,4-Benzothiadiazine, 3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-phenyl-, 1,1-dioxide, 3-(3,5-Dimethyl-1H-pyrazol-1-yl)-4-phenyl-4H-1,2,4-benzothiadiazine 1,1-dioxide, 3-(3,5-Dimethyl-1H-pyrazol-1-yl)-4-phenyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione, BRN 5629728
| Molecular Formula | C18H16N4O2S |
|---|---|
| Molecular Weight | 352.10 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 75.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 352.0994 |
| Heavy Atoms | 25 |
| Complexity | 623.0 |
Chemical Identifiers
| CAS Number | 107089-84-9 |
|---|---|
| SMILES | CC1=CC(=NN1C2=NS(=O)(=O)C3=CC=CC=C3N2C4=CC=CC=C4)C |
| InChIKey | KLBCIEMVHIIZDO-UHFFFAOYSA-N |
Product Overview
RefChem:296899 (CAS 107089-84-9), with molecular formula C18H16N4O2S and molecular weight 352.10 g/mol. IUPAC: 3-(3,5-dimethylpyrazol-1-yl)-4-phenyl-1λ6,2,4-benzothiadiazine 1,1-dioxide.
Chemical Property Profile of RefChem:296899
Property Insights of RefChem:296899
The XLogP value of 3.3 indicates that RefChem:296899 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.9 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:296899. Following Lipinski's Rule of Five, RefChem:296899 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 RefChem:296899?
The CAS number of RefChem:296899 is 107089-84-9.
What is the molecular formula of RefChem:296899?
The molecular formula of RefChem:296899 is C18H16N4O2S.
What is the molecular weight of RefChem:296899?
The molecular weight of RefChem:296899 is 352.10 g/mol.
Where can I buy RefChem:296899?
You can request a quote for RefChem:296899 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:296899?
Yes, KEHONG BIO provides custom synthesis services for RefChem:296899 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.