Benzenesulfonamide, 4-butoxy-2-methyl-N-((methylamino)thioxomethyl)-
TL;DR: Benzenesulfonamide, 4-butoxy-2-methyl-N-((methylamino)thioxomethyl)- (CAS 68499-43-4) is a chemical compound with molecular formula C13H20N2O3S2 and molecular weight 316.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-butoxy-2-methylphenyl)sulfonyl-3-methylthiourea
Also Known As: Benzenesulfonamide, 4-butoxy-2-methyl-N-((methylamino)thioxomethyl)-, 4-Butoxy-2-methyl-N-((methylamino)thioxomethyl)benzenesulfonamide, 1-(4-butoxy-2-methylphenyl)sulfonyl-3-methylthiourea, 4-Butoxy-2-methyl-N-(methylcarbamothioyl)benzene-1-sulfonamide, BRN 2876695
| Molecular Formula | C13H20N2O3S2 |
|---|---|
| Molecular Weight | 316.09 g/mol |
| LogP | 1.95652 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 316.09152 |
| Heavy Atoms | 20 |
| Complexity | 570.97906 |
Chemical Identifiers
| CAS Number | 68499-43-4 |
|---|---|
| SMILES | CCCCOC1=CC(=C(C=C1)S(=O)(=O)NC(=S)NC)C |
Product Overview
Benzenesulfonamide, 4-butoxy-2-methyl-N-((methylamino)thioxomethyl)- (CAS 68499-43-4), with molecular formula C13H20N2O3S2 and molecular weight 316.09 g/mol. IUPAC: 1-(4-butoxy-2-methylphenyl)sulfonyl-3-methylthiourea.
Chemical Property Profile of Benzenesulfonamide, 4-butoxy-2-methyl-N-((methylamino)thioxomethyl)-
Property Insights of Benzenesulfonamide, 4-butoxy-2-methyl-N-((methylamino)thioxomethyl)-
The XLogP value of 1.95652 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenesulfonamide, 4-butoxy-2-methyl-N-((methylamino)thioxomethyl)-. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenesulfonamide, 4-butoxy-2-methyl-N-((methylamino)thioxomethyl)-. Following Lipinski's Rule of Five, Benzenesulfonamide, 4-butoxy-2-methyl-N-((methylamino)thioxomethyl)- has 2 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 Benzenesulfonamide, 4-butoxy-2-methyl-N-((methylamino)thioxomethyl)-?
The CAS number of Benzenesulfonamide, 4-butoxy-2-methyl-N-((methylamino)thioxomethyl)- is 68499-43-4.
What is the molecular formula of Benzenesulfonamide, 4-butoxy-2-methyl-N-((methylamino)thioxomethyl)-?
The molecular formula of Benzenesulfonamide, 4-butoxy-2-methyl-N-((methylamino)thioxomethyl)- is C13H20N2O3S2.
What is the molecular weight of Benzenesulfonamide, 4-butoxy-2-methyl-N-((methylamino)thioxomethyl)-?
The molecular weight of Benzenesulfonamide, 4-butoxy-2-methyl-N-((methylamino)thioxomethyl)- is 316.09 g/mol.
Where can I buy Benzenesulfonamide, 4-butoxy-2-methyl-N-((methylamino)thioxomethyl)-?
You can request a quote for Benzenesulfonamide, 4-butoxy-2-methyl-N-((methylamino)thioxomethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenesulfonamide, 4-butoxy-2-methyl-N-((methylamino)thioxomethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzenesulfonamide, 4-butoxy-2-methyl-N-((methylamino)thioxomethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.