N-Methylacetohexamide
TL;DR: N-Methylacetohexamide (CAS 78366-44-6) is a chemical compound with molecular formula C16H22N2O4S and molecular weight 338.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-acetylphenyl)sulfonyl-3-cyclohexyl-1-methylurea
Also Known As: N-Methylacetohexamide, Acetohexamide, N-methyl-, 4-acetyl-n-(cyclohexylcarbamoyl)-n-methylbenzenesulfonamide, 1-(4-acetylphenyl)sulfonyl-3-cyclohexyl-1-methylurea, 1-(4-acetylphenyl)sulfonyl-3-cyclohexyl-1-methyl-urea
| Molecular Formula | C16H22N2O4S |
|---|---|
| Molecular Weight | 338.13 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 91.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 338.13004 |
| Heavy Atoms | 23 |
| Complexity | 527.0 |
Chemical Identifiers
| CAS Number | 78366-44-6 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)C(=O)NC2CCCCC2 |
| InChIKey | LJUVADVEZRRERT-UHFFFAOYSA-N |
Product Overview
N-Methylacetohexamide (CAS 78366-44-6), with molecular formula C16H22N2O4S and molecular weight 338.13 g/mol. IUPAC: 1-(4-acetylphenyl)sulfonyl-3-cyclohexyl-1-methylurea.
Chemical Property Profile of N-Methylacetohexamide
Property Insights of N-Methylacetohexamide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Methylacetohexamide. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Methylacetohexamide. Following Lipinski's Rule of Five, N-Methylacetohexamide has 1 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 N-Methylacetohexamide?
The CAS number of N-Methylacetohexamide is 78366-44-6.
What is the molecular formula of N-Methylacetohexamide?
The molecular formula of N-Methylacetohexamide is C16H22N2O4S.
What is the molecular weight of N-Methylacetohexamide?
The molecular weight of N-Methylacetohexamide is 338.13 g/mol.
Where can I buy N-Methylacetohexamide?
You can request a quote for N-Methylacetohexamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Methylacetohexamide?
Yes, KEHONG BIO provides custom synthesis services for N-Methylacetohexamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.