N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(furan-2-ylmethyl)-2-nitrobenzamide
TL;DR: N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(furan-2-ylmethyl)-2-nitrobenzamide (CAS 714286-58-5) is a chemical compound with molecular formula C16H16N2O6S and molecular weight 364.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,1-dioxothiolan-3-yl)-N-(furan-2-ylmethyl)-2-nitrobenzamide
Also Known As: N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(furan-2-ylmethyl)-2-nitrobenzamide, N-(1,1-dioxothiolan-3-yl)-N-(furan-2-ylmethyl)-2-nitrobenzamide, N-(11-DIOXO-1LAMBDA6-THIOLAN-3-YL)-N-[(FURAN-2-YL)METHYL]-2-NITROBENZAMIDE
| Molecular Formula | C16H16N2O6S |
|---|---|
| Molecular Weight | 364.07 g/mol |
| LogP | 2.0173 |
| Topological Polar Surface Area | 110.73 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 364.0729 |
| Heavy Atoms | 25 |
| Complexity | 891.1086 |
Chemical Identifiers
| CAS Number | 714286-58-5 |
|---|---|
| SMILES | C1CS(=O)(=O)CC1N(CC2=CC=CO2)C(=O)C3=CC=CC=C3[N+](=O)[O-] |
Product Overview
N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(furan-2-ylmethyl)-2-nitrobenzamide (CAS 714286-58-5), with molecular formula C16H16N2O6S and molecular weight 364.07 g/mol. IUPAC: N-(1,1-dioxothiolan-3-yl)-N-(furan-2-ylmethyl)-2-nitrobenzamide.
Chemical Property Profile of N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(furan-2-ylmethyl)-2-nitrobenzamide
Property Insights of N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(furan-2-ylmethyl)-2-nitrobenzamide
The XLogP value of 2.0173 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(furan-2-ylmethyl)-2-nitrobenzamide. The TPSA of 110.73 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(furan-2-ylmethyl)-2-nitrobenzamide. Following Lipinski's Rule of Five, N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(furan-2-ylmethyl)-2-nitrobenzamide has 0 hydrogen bond donor(s) and 6 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)-N-(furan-2-ylmethyl)-2-nitrobenzamide?
The CAS number of N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(furan-2-ylmethyl)-2-nitrobenzamide is 714286-58-5.
What is the molecular formula of N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(furan-2-ylmethyl)-2-nitrobenzamide?
The molecular formula of N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(furan-2-ylmethyl)-2-nitrobenzamide is C16H16N2O6S.
What is the molecular weight of N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(furan-2-ylmethyl)-2-nitrobenzamide?
The molecular weight of N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(furan-2-ylmethyl)-2-nitrobenzamide is 364.07 g/mol.
Where can I buy N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(furan-2-ylmethyl)-2-nitrobenzamide?
You can request a quote for N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(furan-2-ylmethyl)-2-nitrobenzamide 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)-N-(furan-2-ylmethyl)-2-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(furan-2-ylmethyl)-2-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.