3-isopropoxy-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)benzamide
TL;DR: 3-isopropoxy-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)benzamide (CAS 847471-54-9) is a chemical compound with molecular formula C17H17N3O2S and molecular weight 327.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-methyl-2,1,3-benzothiadiazol-4-yl)-3-propan-2-yloxybenzamide
Also Known As: BAS 11194400, 3-isopropoxy-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)benzamide, N-(5-methyl-2,1,3-benzothiadiazol-4-yl)-3-(propan-2-yloxy)benzamide, N-(5-methyl-2,1,3-benzothiadiazol-4-yl)-3-propan-2-yloxybenzamide, 3-Isopropoxy-N-(5-methyl-benzo[1,2,5]thiadiazol-4-yl)-benzamide
| Molecular Formula | C17H17N3O2S |
|---|---|
| Molecular Weight | 327.10 g/mol |
| LogP | 4.03922 |
| Topological Polar Surface Area | 64.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 327.10416 |
| Heavy Atoms | 23 |
| Complexity | 857.9207 |
Chemical Identifiers
| CAS Number | 847471-54-9 |
|---|---|
| SMILES | CC1=C(C2=NSN=C2C=C1)NC(=O)C3=CC(=CC=C3)OC(C)C |
Product Overview
3-isopropoxy-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)benzamide (CAS 847471-54-9), with molecular formula C17H17N3O2S and molecular weight 327.10 g/mol. IUPAC: N-(5-methyl-2,1,3-benzothiadiazol-4-yl)-3-propan-2-yloxybenzamide.
Chemical Property Profile of 3-isopropoxy-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)benzamide
Property Insights of 3-isopropoxy-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)benzamide
The XLogP value of 4.03922 indicates that 3-isopropoxy-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.11 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-isopropoxy-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)benzamide. Following Lipinski's Rule of Five, 3-isopropoxy-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)benzamide 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 3-isopropoxy-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)benzamide?
The CAS number of 3-isopropoxy-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)benzamide is 847471-54-9.
What is the molecular formula of 3-isopropoxy-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)benzamide?
The molecular formula of 3-isopropoxy-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)benzamide is C17H17N3O2S.
What is the molecular weight of 3-isopropoxy-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)benzamide?
The molecular weight of 3-isopropoxy-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)benzamide is 327.10 g/mol.
Where can I buy 3-isopropoxy-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)benzamide?
You can request a quote for 3-isopropoxy-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-isopropoxy-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-isopropoxy-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.