N-(2,1,3-benzothiadiazol-4-yl)-3,4,5-trimethoxybenzamide
TL;DR: N-(2,1,3-benzothiadiazol-4-yl)-3,4,5-trimethoxybenzamide (CAS 6237-38-3) is a chemical compound with molecular formula C16H15N3O4S and molecular weight 345.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,1,3-benzothiadiazol-4-yl)-3,4,5-trimethoxybenzamide
Also Known As: N-(2,1,3-benzothiadiazol-4-yl)-3,4,5-trimethoxybenzamide, BAS 02243425, BIM-0005358.P001, AB00104715-01, N-2,1,3-benzothiadiazol-4-yl-3,4,5-trimethoxybenzamide
| Molecular Formula | C16H15N3O4S |
|---|---|
| Molecular Weight | 345.08 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 345.07834 |
| Heavy Atoms | 24 |
| Complexity | 428.0 |
Chemical Identifiers
| CAS Number | 6237-38-3 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)NC2=CC=CC3=NSN=C32 |
| InChIKey | VFCJKGAJTRJXCJ-UHFFFAOYSA-N |
Product Overview
N-(2,1,3-benzothiadiazol-4-yl)-3,4,5-trimethoxybenzamide (CAS 6237-38-3), with molecular formula C16H15N3O4S and molecular weight 345.08 g/mol. IUPAC: N-(2,1,3-benzothiadiazol-4-yl)-3,4,5-trimethoxybenzamide.
Chemical Property Profile of N-(2,1,3-benzothiadiazol-4-yl)-3,4,5-trimethoxybenzamide
Property Insights of N-(2,1,3-benzothiadiazol-4-yl)-3,4,5-trimethoxybenzamide
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,1,3-benzothiadiazol-4-yl)-3,4,5-trimethoxybenzamide. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,1,3-benzothiadiazol-4-yl)-3,4,5-trimethoxybenzamide. Following Lipinski's Rule of Five, N-(2,1,3-benzothiadiazol-4-yl)-3,4,5-trimethoxybenzamide has 1 hydrogen bond donor(s) and 7 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 N-(2,1,3-benzothiadiazol-4-yl)-3,4,5-trimethoxybenzamide?
The CAS number of N-(2,1,3-benzothiadiazol-4-yl)-3,4,5-trimethoxybenzamide is 6237-38-3.
What is the molecular formula of N-(2,1,3-benzothiadiazol-4-yl)-3,4,5-trimethoxybenzamide?
The molecular formula of N-(2,1,3-benzothiadiazol-4-yl)-3,4,5-trimethoxybenzamide is C16H15N3O4S.
What is the molecular weight of N-(2,1,3-benzothiadiazol-4-yl)-3,4,5-trimethoxybenzamide?
The molecular weight of N-(2,1,3-benzothiadiazol-4-yl)-3,4,5-trimethoxybenzamide is 345.08 g/mol.
Where can I buy N-(2,1,3-benzothiadiazol-4-yl)-3,4,5-trimethoxybenzamide?
You can request a quote for N-(2,1,3-benzothiadiazol-4-yl)-3,4,5-trimethoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,1,3-benzothiadiazol-4-yl)-3,4,5-trimethoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,1,3-benzothiadiazol-4-yl)-3,4,5-trimethoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.