N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxy-N-(4-methoxybenzyl)benzamide
TL;DR: N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxy-N-(4-methoxybenzyl)benzamide (CAS 877804-98-3) is a chemical compound with molecular formula C21H25NO5S and molecular weight 403.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,1-dioxothiolan-3-yl)-2-ethoxy-N-[(4-methoxyphenyl)methyl]benzamide
Also Known As: N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxy-N-(4-methoxybenzyl)benzamide, N-(1,1-dioxothiolan-3-yl)-2-ethoxy-N-[(4-methoxyphenyl)methyl]benzamide
| Molecular Formula | C21H25NO5S |
|---|---|
| Molecular Weight | 403.15 g/mol |
| LogP | 2.9234 |
| Topological Polar Surface Area | 72.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 403.14536 |
| Heavy Atoms | 28 |
| Complexity | 924.0671 |
Chemical Identifiers
| CAS Number | 877804-98-3 |
|---|---|
| SMILES | CCOC1=CC=CC=C1C(=O)N(CC2=CC=C(C=C2)OC)C3CCS(=O)(=O)C3 |
Product Overview
N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxy-N-(4-methoxybenzyl)benzamide (CAS 877804-98-3), with molecular formula C21H25NO5S and molecular weight 403.15 g/mol. IUPAC: N-(1,1-dioxothiolan-3-yl)-2-ethoxy-N-[(4-methoxyphenyl)methyl]benzamide.
Chemical Property Profile of N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxy-N-(4-methoxybenzyl)benzamide
Property Insights of N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxy-N-(4-methoxybenzyl)benzamide
The XLogP value of 2.9234 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxy-N-(4-methoxybenzyl)benzamide. The TPSA of 72.91 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxy-N-(4-methoxybenzyl)benzamide. Following Lipinski's Rule of Five, N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxy-N-(4-methoxybenzyl)benzamide has 0 hydrogen bond donor(s) and 5 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-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxy-N-(4-methoxybenzyl)benzamide?
The CAS number of N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxy-N-(4-methoxybenzyl)benzamide is 877804-98-3.
What is the molecular formula of N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxy-N-(4-methoxybenzyl)benzamide?
The molecular formula of N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxy-N-(4-methoxybenzyl)benzamide is C21H25NO5S.
What is the molecular weight of N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxy-N-(4-methoxybenzyl)benzamide?
The molecular weight of N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxy-N-(4-methoxybenzyl)benzamide is 403.15 g/mol.
Where can I buy N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxy-N-(4-methoxybenzyl)benzamide?
You can request a quote for N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxy-N-(4-methoxybenzyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxy-N-(4-methoxybenzyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-ethoxy-N-(4-methoxybenzyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.