2-(4-isopropoxyphenoxy)-N-((5-methylbenzo[c][1,2,5]thiadiazol-4-yl)carbamothioyl)acetamide
TL;DR: 2-(4-isopropoxyphenoxy)-N-((5-methylbenzo[c][1,2,5]thiadiazol-4-yl)carbamothioyl)acetamide (CAS 710979-56-9) is a chemical compound with molecular formula C19H20N4O3S2 and molecular weight 416.10 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)carbamothioyl]-2-(4-propan-2-yloxyphenoxy)acetamide
Also Known As: 2-(4-isopropoxyphenoxy)-N-((5-methylbenzo[c][1,2,5]thiadiazol-4-yl)carbamothioyl)acetamide, N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]-2-(4-propan-2-yloxyphenoxy)acetamide, N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]-2-[4-(propan-2-yloxy)phenoxy]acetamide
| Molecular Formula | C19H20N4O3S2 |
|---|---|
| Molecular Weight | 416.10 g/mol |
| LogP | 3.67892 |
| Topological Polar Surface Area | 85.37 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 416.0977 |
| Heavy Atoms | 28 |
| Complexity | 986.5123 |
Chemical Identifiers
| CAS Number | 710979-56-9 |
|---|---|
| SMILES | CC1=C(C2=NSN=C2C=C1)NC(=S)NC(=O)COC3=CC=C(C=C3)OC(C)C |
Product Overview
2-(4-isopropoxyphenoxy)-N-((5-methylbenzo[c][1,2,5]thiadiazol-4-yl)carbamothioyl)acetamide (CAS 710979-56-9), with molecular formula C19H20N4O3S2 and molecular weight 416.10 g/mol. IUPAC: N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]-2-(4-propan-2-yloxyphenoxy)acetamide.
Chemical Property Profile of 2-(4-isopropoxyphenoxy)-N-((5-methylbenzo[c][1,2,5]thiadiazol-4-yl)carbamothioyl)acetamide
Property Insights of 2-(4-isopropoxyphenoxy)-N-((5-methylbenzo[c][1,2,5]thiadiazol-4-yl)carbamothioyl)acetamide
The XLogP value of 3.67892 indicates that 2-(4-isopropoxyphenoxy)-N-((5-methylbenzo[c][1,2,5]thiadiazol-4-yl)carbamothioyl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.37 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-isopropoxyphenoxy)-N-((5-methylbenzo[c][1,2,5]thiadiazol-4-yl)carbamothioyl)acetamide. Following Lipinski's Rule of Five, 2-(4-isopropoxyphenoxy)-N-((5-methylbenzo[c][1,2,5]thiadiazol-4-yl)carbamothioyl)acetamide has 2 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 2-(4-isopropoxyphenoxy)-N-((5-methylbenzo[c][1,2,5]thiadiazol-4-yl)carbamothioyl)acetamide?
The CAS number of 2-(4-isopropoxyphenoxy)-N-((5-methylbenzo[c][1,2,5]thiadiazol-4-yl)carbamothioyl)acetamide is 710979-56-9.
What is the molecular formula of 2-(4-isopropoxyphenoxy)-N-((5-methylbenzo[c][1,2,5]thiadiazol-4-yl)carbamothioyl)acetamide?
The molecular formula of 2-(4-isopropoxyphenoxy)-N-((5-methylbenzo[c][1,2,5]thiadiazol-4-yl)carbamothioyl)acetamide is C19H20N4O3S2.
What is the molecular weight of 2-(4-isopropoxyphenoxy)-N-((5-methylbenzo[c][1,2,5]thiadiazol-4-yl)carbamothioyl)acetamide?
The molecular weight of 2-(4-isopropoxyphenoxy)-N-((5-methylbenzo[c][1,2,5]thiadiazol-4-yl)carbamothioyl)acetamide is 416.10 g/mol.
Where can I buy 2-(4-isopropoxyphenoxy)-N-((5-methylbenzo[c][1,2,5]thiadiazol-4-yl)carbamothioyl)acetamide?
You can request a quote for 2-(4-isopropoxyphenoxy)-N-((5-methylbenzo[c][1,2,5]thiadiazol-4-yl)carbamothioyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-isopropoxyphenoxy)-N-((5-methylbenzo[c][1,2,5]thiadiazol-4-yl)carbamothioyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-isopropoxyphenoxy)-N-((5-methylbenzo[c][1,2,5]thiadiazol-4-yl)carbamothioyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.