Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-methoxy-2-methyl-
TL;DR: Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-methoxy-2-methyl- (CAS 68978-21-2) 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-butyl-3-(4-methoxy-2-methylphenyl)sulfonylthiourea
Also Known As: Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-methoxy-2-methyl-, N-((Butylamino)thioxomethyl)-4-methoxy-2-methylbenzenesulfonamide, 1-butyl-3-(4-methoxy-2-methylphenyl)sulfonylthiourea, N-(Butylcarbamothioyl)-4-methoxy-2-methylbenzene-1-sulfonamide, BRN 2876673
| 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 | 68978-21-2 |
|---|---|
| SMILES | CCCCNC(=S)NS(=O)(=O)C1=C(C=C(C=C1)OC)C |
Product Overview
Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-methoxy-2-methyl- (CAS 68978-21-2), with molecular formula C13H20N2O3S2 and molecular weight 316.09 g/mol. IUPAC: 1-butyl-3-(4-methoxy-2-methylphenyl)sulfonylthiourea.
Chemical Property Profile of Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-methoxy-2-methyl-
Property Insights of Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-methoxy-2-methyl-
The XLogP value of 1.95652 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-methoxy-2-methyl-. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-methoxy-2-methyl-. Following Lipinski's Rule of Five, Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-methoxy-2-methyl- 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, N-((butylamino)thioxomethyl)-4-methoxy-2-methyl-?
The CAS number of Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-methoxy-2-methyl- is 68978-21-2.
What is the molecular formula of Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-methoxy-2-methyl-?
The molecular formula of Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-methoxy-2-methyl- is C13H20N2O3S2.
What is the molecular weight of Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-methoxy-2-methyl-?
The molecular weight of Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-methoxy-2-methyl- is 316.09 g/mol.
Where can I buy Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-methoxy-2-methyl-?
You can request a quote for Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-methoxy-2-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-methoxy-2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-methoxy-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.