N1-(4-chloro-3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-N2-isobutyloxalamide
TL;DR: N1-(4-chloro-3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-N2-isobutyloxalamide (CAS 1105216-62-3) is a chemical compound with molecular formula C15H20ClN3O4S and molecular weight 373.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[4-chloro-3-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-N-(2-methylpropyl)oxamide
Also Known As: F2761-0380, N'-[4-chloro-3-(1,1-dioxo-1lambda6,2-thiazolidin-2-yl)phenyl]-N-(2-methylpropyl)ethanediamide, N1-(4-chloro-3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-N2-isobutyloxalamide, N'-[4-chloro-3-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-N-(2-methylpropyl)oxamide
| Molecular Formula | C15H20ClN3O4S |
|---|---|
| Molecular Weight | 373.09 g/mol |
| LogP | 1.5906 |
| Topological Polar Surface Area | 95.58 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 373.0863 |
| Heavy Atoms | 24 |
| Complexity | 749.0861 |
Chemical Identifiers
| CAS Number | 1105216-62-3 |
|---|---|
| SMILES | CC(C)CNC(=O)C(=O)NC1=CC(=C(C=C1)Cl)N2CCCS2(=O)=O |
Product Overview
N1-(4-chloro-3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-N2-isobutyloxalamide (CAS 1105216-62-3), with molecular formula C15H20ClN3O4S and molecular weight 373.09 g/mol. IUPAC: N'-[4-chloro-3-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-N-(2-methylpropyl)oxamide.
Chemical Property Profile of N1-(4-chloro-3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-N2-isobutyloxalamide
Property Insights of N1-(4-chloro-3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-N2-isobutyloxalamide
The XLogP value of 1.5906 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N1-(4-chloro-3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-N2-isobutyloxalamide. The TPSA of 95.58 Ų falls within the moderate polarity range, balancing permeability and solubility for N1-(4-chloro-3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-N2-isobutyloxalamide. Following Lipinski's Rule of Five, N1-(4-chloro-3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-N2-isobutyloxalamide has 2 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 N1-(4-chloro-3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-N2-isobutyloxalamide?
The CAS number of N1-(4-chloro-3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-N2-isobutyloxalamide is 1105216-62-3.
What is the molecular formula of N1-(4-chloro-3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-N2-isobutyloxalamide?
The molecular formula of N1-(4-chloro-3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-N2-isobutyloxalamide is C15H20ClN3O4S.
What is the molecular weight of N1-(4-chloro-3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-N2-isobutyloxalamide?
The molecular weight of N1-(4-chloro-3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-N2-isobutyloxalamide is 373.09 g/mol.
Where can I buy N1-(4-chloro-3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-N2-isobutyloxalamide?
You can request a quote for N1-(4-chloro-3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-N2-isobutyloxalamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N1-(4-chloro-3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-N2-isobutyloxalamide?
Yes, KEHONG BIO provides custom synthesis services for N1-(4-chloro-3-(1,1-dioxidoisothiazolidin-2-yl)phenyl)-N2-isobutyloxalamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.