2-(4-chloro-3,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)propanamide
TL;DR: 2-(4-chloro-3,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)propanamide (CAS 618080-20-9) is a chemical compound with molecular formula C15H20ClNO4S and molecular weight 345.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chloro-3,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)propanamide
Also Known As: AF-399/41899842, 2-(4-chloro-3,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)propanamide, 2-(4-chloro-3,5-dimethylphenoxy)-N-(1,1-dioxidotetrahydro-3-thienyl)propanamide, N-(1,1-dioxothiolan-3-yl)-2-(4-chloro-3,5-dimethylphenoxy)propanamide
| Molecular Formula | C15H20ClNO4S |
|---|---|
| Molecular Weight | 345.08 g/mol |
| LogP | 2.02744 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 345.08017 |
| Heavy Atoms | 22 |
| Complexity | 663.778 |
Chemical Identifiers
| CAS Number | 618080-20-9 |
|---|---|
| SMILES | CC1=CC(=CC(=C1Cl)C)OC(C)C(=O)NC2CCS(=O)(=O)C2 |
Product Overview
2-(4-chloro-3,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)propanamide (CAS 618080-20-9), with molecular formula C15H20ClNO4S and molecular weight 345.08 g/mol. IUPAC: 2-(4-chloro-3,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)propanamide.
Chemical Property Profile of 2-(4-chloro-3,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)propanamide
Property Insights of 2-(4-chloro-3,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)propanamide
The XLogP value of 2.02744 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-chloro-3,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)propanamide. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-chloro-3,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)propanamide. Following Lipinski's Rule of Five, 2-(4-chloro-3,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)propanamide 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 2-(4-chloro-3,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)propanamide?
The CAS number of 2-(4-chloro-3,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)propanamide is 618080-20-9.
What is the molecular formula of 2-(4-chloro-3,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)propanamide?
The molecular formula of 2-(4-chloro-3,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)propanamide is C15H20ClNO4S.
What is the molecular weight of 2-(4-chloro-3,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)propanamide?
The molecular weight of 2-(4-chloro-3,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)propanamide is 345.08 g/mol.
Where can I buy 2-(4-chloro-3,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)propanamide?
You can request a quote for 2-(4-chloro-3,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-chloro-3,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-chloro-3,5-dimethylphenoxy)-N-(1,1-dioxothiolan-3-yl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.