N-benzyl-2-(3,5-dimethylphenoxy)-N-(1,1-dioxidotetrahydrothiophen-3-yl)acetamide
TL;DR: N-benzyl-2-(3,5-dimethylphenoxy)-N-(1,1-dioxidotetrahydrothiophen-3-yl)acetamide (CAS 577998-24-4) is a chemical compound with molecular formula C21H25NO4S and molecular weight 387.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-2-(3,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)acetamide
Also Known As: N-benzyl-2-(3,5-dimethylphenoxy)-N-(1,1-dioxidotetrahydrothiophen-3-yl)acetamide, N-benzyl-2-(3,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)acetamide
| Molecular Formula | C21H25NO4S |
|---|---|
| Molecular Weight | 387.15 g/mol |
| LogP | 2.89814 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 387.15042 |
| Heavy Atoms | 27 |
| Complexity | 888.78375 |
Chemical Identifiers
| CAS Number | 577998-24-4 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)OCC(=O)N(CC2=CC=CC=C2)C3CCS(=O)(=O)C3)C |
Product Overview
N-benzyl-2-(3,5-dimethylphenoxy)-N-(1,1-dioxidotetrahydrothiophen-3-yl)acetamide (CAS 577998-24-4), with molecular formula C21H25NO4S and molecular weight 387.15 g/mol. IUPAC: N-benzyl-2-(3,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)acetamide.
Chemical Property Profile of N-benzyl-2-(3,5-dimethylphenoxy)-N-(1,1-dioxidotetrahydrothiophen-3-yl)acetamide
Property Insights of N-benzyl-2-(3,5-dimethylphenoxy)-N-(1,1-dioxidotetrahydrothiophen-3-yl)acetamide
The XLogP value of 2.89814 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-benzyl-2-(3,5-dimethylphenoxy)-N-(1,1-dioxidotetrahydrothiophen-3-yl)acetamide. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for N-benzyl-2-(3,5-dimethylphenoxy)-N-(1,1-dioxidotetrahydrothiophen-3-yl)acetamide. Following Lipinski's Rule of Five, N-benzyl-2-(3,5-dimethylphenoxy)-N-(1,1-dioxidotetrahydrothiophen-3-yl)acetamide has 0 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-benzyl-2-(3,5-dimethylphenoxy)-N-(1,1-dioxidotetrahydrothiophen-3-yl)acetamide?
The CAS number of N-benzyl-2-(3,5-dimethylphenoxy)-N-(1,1-dioxidotetrahydrothiophen-3-yl)acetamide is 577998-24-4.
What is the molecular formula of N-benzyl-2-(3,5-dimethylphenoxy)-N-(1,1-dioxidotetrahydrothiophen-3-yl)acetamide?
The molecular formula of N-benzyl-2-(3,5-dimethylphenoxy)-N-(1,1-dioxidotetrahydrothiophen-3-yl)acetamide is C21H25NO4S.
What is the molecular weight of N-benzyl-2-(3,5-dimethylphenoxy)-N-(1,1-dioxidotetrahydrothiophen-3-yl)acetamide?
The molecular weight of N-benzyl-2-(3,5-dimethylphenoxy)-N-(1,1-dioxidotetrahydrothiophen-3-yl)acetamide is 387.15 g/mol.
Where can I buy N-benzyl-2-(3,5-dimethylphenoxy)-N-(1,1-dioxidotetrahydrothiophen-3-yl)acetamide?
You can request a quote for N-benzyl-2-(3,5-dimethylphenoxy)-N-(1,1-dioxidotetrahydrothiophen-3-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-2-(3,5-dimethylphenoxy)-N-(1,1-dioxidotetrahydrothiophen-3-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-2-(3,5-dimethylphenoxy)-N-(1,1-dioxidotetrahydrothiophen-3-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.