N-(2-chlorobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxybenzamide
TL;DR: N-(2-chlorobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxybenzamide (CAS 877646-25-8) is a chemical compound with molecular formula C20H22ClNO4S and molecular weight 407.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-chlorophenyl)methyl]-N-(1,1-dioxothiolan-3-yl)-2-ethoxybenzamide
Also Known As: N-(2-chlorobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxybenzamide, AO-022/43361941, N-[(2-chlorophenyl)methyl]-N-(1,1-dioxothiolan-3-yl)-2-ethoxybenzamide, N-(2-chlorobenzyl)-N-(1,1-dioxidotetrahydro-3-thienyl)-2-ethoxybenzamide, N-[(2-CHLOROPHENYL)METHYL]-N-(1,1-DIOXO-1??-THIOLAN-3-YL)-2-ETHOXYBENZAMIDE
| Molecular Formula | C20H22ClNO4S |
|---|---|
| Molecular Weight | 407.10 g/mol |
| LogP | 3.5682 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 407.0958 |
| Heavy Atoms | 27 |
| Complexity | 929.08386 |
Chemical Identifiers
| CAS Number | 877646-25-8 |
|---|---|
| SMILES | CCOC1=CC=CC=C1C(=O)N(CC2=CC=CC=C2Cl)C3CCS(=O)(=O)C3 |
Product Overview
N-(2-chlorobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxybenzamide (CAS 877646-25-8), with molecular formula C20H22ClNO4S and molecular weight 407.10 g/mol. IUPAC: N-[(2-chlorophenyl)methyl]-N-(1,1-dioxothiolan-3-yl)-2-ethoxybenzamide.
Chemical Property Profile of N-(2-chlorobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxybenzamide
Property Insights of N-(2-chlorobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxybenzamide
The XLogP value of 3.5682 indicates that N-(2-chlorobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-chlorobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxybenzamide. Following Lipinski's Rule of Five, N-(2-chlorobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxybenzamide 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-(2-chlorobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxybenzamide?
The CAS number of N-(2-chlorobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxybenzamide is 877646-25-8.
What is the molecular formula of N-(2-chlorobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxybenzamide?
The molecular formula of N-(2-chlorobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxybenzamide is C20H22ClNO4S.
What is the molecular weight of N-(2-chlorobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxybenzamide?
The molecular weight of N-(2-chlorobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxybenzamide is 407.10 g/mol.
Where can I buy N-(2-chlorobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxybenzamide?
You can request a quote for N-(2-chlorobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-chlorobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-chlorobenzyl)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.