N-(3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-3-methylbenzamide
TL;DR: N-(3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-3-methylbenzamide (CAS 941886-40-4) is a chemical compound with molecular formula C17H18N2O3S and molecular weight 330.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-3-methylbenzamide
Also Known As: F2761-0096, N-(3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-3-methylbenzamide, N-[3-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-3-methylbenzamide, N-[3-(1,1-dioxo-1lambda6,2-thiazolidin-2-yl)phenyl]-3-methylbenzamide
| Molecular Formula | C17H18N2O3S |
|---|---|
| Molecular Weight | 330.10 g/mol |
| LogP | 2.78722 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 330.10382 |
| Heavy Atoms | 23 |
| Complexity | 846.42194 |
Chemical Identifiers
| CAS Number | 941886-40-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)NC2=CC(=CC=C2)N3CCCS3(=O)=O |
Product Overview
N-(3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-3-methylbenzamide (CAS 941886-40-4), with molecular formula C17H18N2O3S and molecular weight 330.10 g/mol. IUPAC: N-[3-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-3-methylbenzamide.
Chemical Property Profile of N-(3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-3-methylbenzamide
Property Insights of N-(3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-3-methylbenzamide
The XLogP value of 2.78722 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-3-methylbenzamide. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-3-methylbenzamide. Following Lipinski's Rule of Five, N-(3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-3-methylbenzamide has 1 hydrogen bond donor(s) and 3 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-(3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-3-methylbenzamide?
The CAS number of N-(3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-3-methylbenzamide is 941886-40-4.
What is the molecular formula of N-(3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-3-methylbenzamide?
The molecular formula of N-(3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-3-methylbenzamide is C17H18N2O3S.
What is the molecular weight of N-(3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-3-methylbenzamide?
The molecular weight of N-(3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-3-methylbenzamide is 330.10 g/mol.
Where can I buy N-(3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-3-methylbenzamide?
You can request a quote for N-(3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-3-methylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-3-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-3-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.