![3-methyl-N-[(4-sulfamoylphenyl)carbamothioyl]butanamide structure](/static/products/6781/678189-95-2.webp)
3-methyl-N-[(4-sulfamoylphenyl)carbamothioyl]butanamide
TL;DR: 3-methyl-N-[(4-sulfamoylphenyl)carbamothioyl]butanamide (CAS 678189-95-2) is a chemical compound with molecular formula C12H17N3O3S2 and molecular weight 315.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-N-[(4-sulfamoylphenyl)carbamothioyl]butanamide
Also Known As: 3-methyl-N-[(4-sulfamoylphenyl)carbamothioyl]butanamide, 3-methyl-N-((4-sulfamoylphenyl)carbamothioyl)butanamide, 3-(3-METHYLBUTANOYL)-1-(4-SULFAMOYLPHENYL)THIOUREA, F1724-0876, AN-329/41401096
| Molecular Formula | C12H17N3O3S2 |
|---|---|
| Molecular Weight | 315.07 g/mol |
| LogP | 1.1931 |
| Topological Polar Surface Area | 101.29 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 315.07114 |
| Heavy Atoms | 20 |
| Complexity | 594.8785 |
Chemical Identifiers
| CAS Number | 678189-95-2 |
|---|---|
| SMILES | CC(C)CC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)N |
Product Overview
3-methyl-N-[(4-sulfamoylphenyl)carbamothioyl]butanamide (CAS 678189-95-2), with molecular formula C12H17N3O3S2 and molecular weight 315.07 g/mol. IUPAC: 3-methyl-N-[(4-sulfamoylphenyl)carbamothioyl]butanamide.
Chemical Property Profile of 3-methyl-N-[(4-sulfamoylphenyl)carbamothioyl]butanamide
Property Insights of 3-methyl-N-[(4-sulfamoylphenyl)carbamothioyl]butanamide
The XLogP value of 1.1931 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-methyl-N-[(4-sulfamoylphenyl)carbamothioyl]butanamide. The TPSA of 101.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-methyl-N-[(4-sulfamoylphenyl)carbamothioyl]butanamide. Following Lipinski's Rule of Five, 3-methyl-N-[(4-sulfamoylphenyl)carbamothioyl]butanamide 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-methyl-N-[(4-sulfamoylphenyl)carbamothioyl]butanamide?
The CAS number of 3-methyl-N-[(4-sulfamoylphenyl)carbamothioyl]butanamide is 678189-95-2.
What is the molecular formula of 3-methyl-N-[(4-sulfamoylphenyl)carbamothioyl]butanamide?
The molecular formula of 3-methyl-N-[(4-sulfamoylphenyl)carbamothioyl]butanamide is C12H17N3O3S2.
What is the molecular weight of 3-methyl-N-[(4-sulfamoylphenyl)carbamothioyl]butanamide?
The molecular weight of 3-methyl-N-[(4-sulfamoylphenyl)carbamothioyl]butanamide is 315.07 g/mol.
Where can I buy 3-methyl-N-[(4-sulfamoylphenyl)carbamothioyl]butanamide?
You can request a quote for 3-methyl-N-[(4-sulfamoylphenyl)carbamothioyl]butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methyl-N-[(4-sulfamoylphenyl)carbamothioyl]butanamide?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-N-[(4-sulfamoylphenyl)carbamothioyl]butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.