![4-bromo-N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]benzamide structure](/static/products/3537/353761-79-2.webp)
4-bromo-N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]benzamide
TL;DR: 4-bromo-N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]benzamide (CAS 353761-79-2) is a chemical compound with molecular formula C15H11BrN4OS2 and molecular weight 405.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]benzamide
Also Known As: AB00105242-01, AN-465/15152127, 4-bromo-N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]benzamide, N-(4-bromobenzoyl)-N'-(5-methyl-2,1,3-benzothiadiazol-4-yl)thiourea
| Molecular Formula | C15H11BrN4OS2 |
|---|---|
| Molecular Weight | 405.96 g/mol |
| LogP | 3.88902 |
| Topological Polar Surface Area | 66.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 405.95578 |
| Heavy Atoms | 23 |
| Complexity | 892.1332 |
Chemical Identifiers
| CAS Number | 353761-79-2 |
|---|---|
| SMILES | CC1=C(C2=NSN=C2C=C1)NC(=S)NC(=O)C3=CC=C(C=C3)Br |
Product Overview
4-bromo-N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]benzamide (CAS 353761-79-2), with molecular formula C15H11BrN4OS2 and molecular weight 405.96 g/mol. IUPAC: 4-bromo-N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]benzamide.
Chemical Property Profile of 4-bromo-N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]benzamide
Property Insights of 4-bromo-N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]benzamide
The XLogP value of 3.88902 indicates that 4-bromo-N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-bromo-N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]benzamide. Following Lipinski's Rule of Five, 4-bromo-N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]benzamide has 2 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 4-bromo-N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]benzamide?
The CAS number of 4-bromo-N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]benzamide is 353761-79-2.
What is the molecular formula of 4-bromo-N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]benzamide?
The molecular formula of 4-bromo-N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]benzamide is C15H11BrN4OS2.
What is the molecular weight of 4-bromo-N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]benzamide?
The molecular weight of 4-bromo-N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]benzamide is 405.96 g/mol.
Where can I buy 4-bromo-N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]benzamide?
You can request a quote for 4-bromo-N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-bromo-N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-N-[(5-methyl-2,1,3-benzothiadiazol-4-yl)carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.