![3-bromo-4-methyl-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide structure](/static/products/7178/717863-15-5.webp)
3-bromo-4-methyl-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide
TL;DR: 3-bromo-4-methyl-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide (CAS 717863-15-5) is a chemical compound with molecular formula C18H20BrN3O3S2 and molecular weight 469.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-4-methyl-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide
Also Known As: AN-329/42685615, 3-bromo-4-methyl-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide, 4-({[(3-bromo-4-methylbenzoyl)amino]carbothioyl}amino)-N-isopropylbenzenesulfonamide, 3-bromo-4-methyl-N-{[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl}benzamide, 3-bromo-N-[({4-[(isopropylamino)sulfonyl]phenyl}amino)carbonothioyl]-4-methylbenzamide
| Molecular Formula | C18H20BrN3O3S2 |
|---|---|
| Molecular Weight | 469.01 g/mol |
| LogP | 3.57102 |
| Topological Polar Surface Area | 87.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 469.01294 |
| Heavy Atoms | 27 |
| Complexity | 958.3172 |
Chemical Identifiers
| CAS Number | 717863-15-5 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC(C)C)Br |
Product Overview
3-bromo-4-methyl-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide (CAS 717863-15-5), with molecular formula C18H20BrN3O3S2 and molecular weight 469.01 g/mol. IUPAC: 3-bromo-4-methyl-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide.
Chemical Property Profile of 3-bromo-4-methyl-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide
Property Insights of 3-bromo-4-methyl-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide
The XLogP value of 3.57102 indicates that 3-bromo-4-methyl-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-bromo-4-methyl-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide. Following Lipinski's Rule of Five, 3-bromo-4-methyl-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide has 3 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 3-bromo-4-methyl-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide?
The CAS number of 3-bromo-4-methyl-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide is 717863-15-5.
What is the molecular formula of 3-bromo-4-methyl-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide?
The molecular formula of 3-bromo-4-methyl-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide is C18H20BrN3O3S2.
What is the molecular weight of 3-bromo-4-methyl-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide?
The molecular weight of 3-bromo-4-methyl-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide is 469.01 g/mol.
Where can I buy 3-bromo-4-methyl-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide?
You can request a quote for 3-bromo-4-methyl-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-bromo-4-methyl-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-bromo-4-methyl-N-[[4-(propan-2-ylsulfamoyl)phenyl]carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.