Acetamide, N-(4-(beta-D-glucopyranosyloxy)phenyl)-N-(1-methylethyl)-2-(methylsulfonyl)-
TL;DR: Acetamide, N-(4-(beta-D-glucopyranosyloxy)phenyl)-N-(1-methylethyl)-2-(methylsulfonyl)- (CAS 80994-62-3) is a chemical compound with molecular formula C18H27NO9S and molecular weight 433.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylsulfonyl-N-propan-2-yl-N-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]acetamide
Also Known As: Acetamide, N-(4-(beta-D-glucopyranosyloxy)phenyl)-N-(1-methylethyl)-2-(methylsulfonyl)-, N-[4-(beta-D-Glucopyranosyloxy)phenyl]-2-(methanesulfonyl)-N-(propan-2-yl)acetamide, N-[4-(Hexopyranosyloxy)phenyl]-2-(methanesulfonyl)-N-(propan-2-yl)acetamide, 2-methylsulfonyl-N-propan-2-yl-N-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]acetamide
| Molecular Formula | C18H27NO9S |
|---|---|
| Molecular Weight | 433.14 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 162.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 433.14066 |
| Heavy Atoms | 29 |
| Complexity | 642.0 |
Chemical Identifiers
| CAS Number | 80994-62-3 |
|---|---|
| SMILES | CC(C)N(C1=CC=C(C=C1)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)C(=O)CS(=O)(=O)C |
| InChIKey | MHNYBGSGHXGBQH-SOVHRIKKSA-N |
Product Overview
Acetamide, N-(4-(beta-D-glucopyranosyloxy)phenyl)-N-(1-methylethyl)-2-(methylsulfonyl)- (CAS 80994-62-3), with molecular formula C18H27NO9S and molecular weight 433.14 g/mol. IUPAC: 2-methylsulfonyl-N-propan-2-yl-N-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]acetamide.
Chemical Property Profile of Acetamide, N-(4-(beta-D-glucopyranosyloxy)phenyl)-N-(1-methylethyl)-2-(methylsulfonyl)-
Property Insights of Acetamide, N-(4-(beta-D-glucopyranosyloxy)phenyl)-N-(1-methylethyl)-2-(methylsulfonyl)-
The XLogP value of -0.8 indicates that Acetamide, N-(4-(beta-D-glucopyranosyloxy)phenyl)-N-(1-methylethyl)-2-(methylsulfonyl)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 162.0 Ų indicates high polarity, suggesting Acetamide, N-(4-(beta-D-glucopyranosyloxy)phenyl)-N-(1-methylethyl)-2-(methylsulfonyl)- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Acetamide, N-(4-(beta-D-glucopyranosyloxy)phenyl)-N-(1-methylethyl)-2-(methylsulfonyl)- has 4 hydrogen bond donor(s) and 9 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 Acetamide, N-(4-(beta-D-glucopyranosyloxy)phenyl)-N-(1-methylethyl)-2-(methylsulfonyl)-?
The CAS number of Acetamide, N-(4-(beta-D-glucopyranosyloxy)phenyl)-N-(1-methylethyl)-2-(methylsulfonyl)- is 80994-62-3.
What is the molecular formula of Acetamide, N-(4-(beta-D-glucopyranosyloxy)phenyl)-N-(1-methylethyl)-2-(methylsulfonyl)-?
The molecular formula of Acetamide, N-(4-(beta-D-glucopyranosyloxy)phenyl)-N-(1-methylethyl)-2-(methylsulfonyl)- is C18H27NO9S.
What is the molecular weight of Acetamide, N-(4-(beta-D-glucopyranosyloxy)phenyl)-N-(1-methylethyl)-2-(methylsulfonyl)-?
The molecular weight of Acetamide, N-(4-(beta-D-glucopyranosyloxy)phenyl)-N-(1-methylethyl)-2-(methylsulfonyl)- is 433.14 g/mol.
Where can I buy Acetamide, N-(4-(beta-D-glucopyranosyloxy)phenyl)-N-(1-methylethyl)-2-(methylsulfonyl)-?
You can request a quote for Acetamide, N-(4-(beta-D-glucopyranosyloxy)phenyl)-N-(1-methylethyl)-2-(methylsulfonyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetamide, N-(4-(beta-D-glucopyranosyloxy)phenyl)-N-(1-methylethyl)-2-(methylsulfonyl)-?
Yes, KEHONG BIO provides custom synthesis services for Acetamide, N-(4-(beta-D-glucopyranosyloxy)phenyl)-N-(1-methylethyl)-2-(methylsulfonyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.