Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-(hexyloxy)-2-methyl-
TL;DR: Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-(hexyloxy)-2-methyl- (CAS 69210-37-3) is a chemical compound with molecular formula C18H30N2O3S2 and molecular weight 386.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-3-(4-hexoxy-2-methylphenyl)sulfonylthiourea
Also Known As: Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-(hexyloxy)-2-methyl-, N-((Butylamino)thioxomethyl)-4-(hexyloxy)-2-methylbenzenesulfonamide, 1-butyl-3-(4-hexoxy-2-methylphenyl)sulfonylthiourea, N-(Butylcarbamothioyl)-4-(hexyloxy)-2-methylbenzene-1-sulfonamide, BRN 2396028
| Molecular Formula | C18H30N2O3S2 |
|---|---|
| Molecular Weight | 386.17 g/mol |
| LogP | 3.90702 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 386.1698 |
| Heavy Atoms | 25 |
| Complexity | 645.7213 |
Chemical Identifiers
| CAS Number | 69210-37-3 |
|---|---|
| SMILES | CCCCCCOC1=CC(=C(C=C1)S(=O)(=O)NC(=S)NCCCC)C |
Product Overview
Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-(hexyloxy)-2-methyl- (CAS 69210-37-3), with molecular formula C18H30N2O3S2 and molecular weight 386.17 g/mol. IUPAC: 1-butyl-3-(4-hexoxy-2-methylphenyl)sulfonylthiourea.
Chemical Property Profile of Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-(hexyloxy)-2-methyl-
Property Insights of Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-(hexyloxy)-2-methyl-
The XLogP value of 3.90702 indicates that Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-(hexyloxy)-2-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-(hexyloxy)-2-methyl-. Following Lipinski's Rule of Five, Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-(hexyloxy)-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-(hexyloxy)-2-methyl-?
The CAS number of Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-(hexyloxy)-2-methyl- is 69210-37-3.
What is the molecular formula of Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-(hexyloxy)-2-methyl-?
The molecular formula of Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-(hexyloxy)-2-methyl- is C18H30N2O3S2.
What is the molecular weight of Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-(hexyloxy)-2-methyl-?
The molecular weight of Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-(hexyloxy)-2-methyl- is 386.17 g/mol.
Where can I buy Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-(hexyloxy)-2-methyl-?
You can request a quote for Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-(hexyloxy)-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-(hexyloxy)-2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzenesulfonamide, N-((butylamino)thioxomethyl)-4-(hexyloxy)-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.