N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-ethyl-4-methylbenzenesulfonamide
TL;DR: N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-ethyl-4-methylbenzenesulfonamide (CAS 698992-65-3) is a chemical compound with molecular formula C13H19NO4S2 and molecular weight 317.08 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-ethyl-4-methylbenzenesulfonamide
Also Known As: F2547-0066, N-(1,1-dioxo-1lambda6-thiolan-3-yl)-N-ethyl-4-methylbenzene-1-sulfonamide, 3-{ethyl[(4-methylphenyl)sulfonyl]amino}thiolane-1,1-dione, A3674/0155774, N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-ethyl-4-methylbenzenesulfonamide
| Molecular Formula | C13H19NO4S2 |
|---|---|
| Molecular Weight | 317.08 g/mol |
| LogP | 1.19272 |
| Topological Polar Surface Area | 71.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 317.07556 |
| Heavy Atoms | 20 |
| Complexity | 677.58624 |
Chemical Identifiers
| CAS Number | 698992-65-3 |
|---|---|
| SMILES | CCN(C1CCS(=O)(=O)C1)S(=O)(=O)C2=CC=C(C=C2)C |
Product Overview
N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-ethyl-4-methylbenzenesulfonamide (CAS 698992-65-3), with molecular formula C13H19NO4S2 and molecular weight 317.08 g/mol. IUPAC: N-(1,1-dioxothiolan-3-yl)-N-ethyl-4-methylbenzenesulfonamide.
Chemical Property Profile of N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-ethyl-4-methylbenzenesulfonamide
Property Insights of N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-ethyl-4-methylbenzenesulfonamide
The XLogP value of 1.19272 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-ethyl-4-methylbenzenesulfonamide. The TPSA of 71.52 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-ethyl-4-methylbenzenesulfonamide. Following Lipinski's Rule of Five, N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-ethyl-4-methylbenzenesulfonamide 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-(1,1-dioxidotetrahydrothiophen-3-yl)-N-ethyl-4-methylbenzenesulfonamide?
The CAS number of N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-ethyl-4-methylbenzenesulfonamide is 698992-65-3.
What is the molecular formula of N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-ethyl-4-methylbenzenesulfonamide?
The molecular formula of N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-ethyl-4-methylbenzenesulfonamide is C13H19NO4S2.
What is the molecular weight of N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-ethyl-4-methylbenzenesulfonamide?
The molecular weight of N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-ethyl-4-methylbenzenesulfonamide is 317.08 g/mol.
Where can I buy N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-ethyl-4-methylbenzenesulfonamide?
You can request a quote for N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-ethyl-4-methylbenzenesulfonamide 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-ethyl-4-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-ethyl-4-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.