N-(1,3-dithiolan-2-ylidene)benzenesulfonamide
TL;DR: N-(1,3-dithiolan-2-ylidene)benzenesulfonamide (CAS 13068-41-2) is a chemical compound with molecular formula C9H9NO2S3 and molecular weight 258.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-dithiolan-2-ylidene)benzenesulfonamide
Also Known As: N-(1,3-dithiolan-2-ylidene)benzenesulfonamide, IFLab1_003958, BAS 00478198, N-[1,3]Dithiolan-2-ylidene-benzenesulfonamide, AB01104076-03
| Molecular Formula | C9H9NO2S3 |
|---|---|
| Molecular Weight | 258.98 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 258.97955 |
| Heavy Atoms | 15 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 13068-41-2 |
|---|---|
| SMILES | C1CSC(=NS(=O)(=O)C2=CC=CC=C2)S1 |
| InChIKey | UMAVVZITDRDUAT-UHFFFAOYSA-N |
Product Overview
N-(1,3-dithiolan-2-ylidene)benzenesulfonamide (CAS 13068-41-2), with molecular formula C9H9NO2S3 and molecular weight 258.98 g/mol. IUPAC: N-(1,3-dithiolan-2-ylidene)benzenesulfonamide.
Chemical Property Profile of N-(1,3-dithiolan-2-ylidene)benzenesulfonamide
Property Insights of N-(1,3-dithiolan-2-ylidene)benzenesulfonamide
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-dithiolan-2-ylidene)benzenesulfonamide. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-dithiolan-2-ylidene)benzenesulfonamide. Following Lipinski's Rule of Five, N-(1,3-dithiolan-2-ylidene)benzenesulfonamide 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-(1,3-dithiolan-2-ylidene)benzenesulfonamide?
The CAS number of N-(1,3-dithiolan-2-ylidene)benzenesulfonamide is 13068-41-2.
What is the molecular formula of N-(1,3-dithiolan-2-ylidene)benzenesulfonamide?
The molecular formula of N-(1,3-dithiolan-2-ylidene)benzenesulfonamide is C9H9NO2S3.
What is the molecular weight of N-(1,3-dithiolan-2-ylidene)benzenesulfonamide?
The molecular weight of N-(1,3-dithiolan-2-ylidene)benzenesulfonamide is 258.98 g/mol.
Where can I buy N-(1,3-dithiolan-2-ylidene)benzenesulfonamide?
You can request a quote for N-(1,3-dithiolan-2-ylidene)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-dithiolan-2-ylidene)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-dithiolan-2-ylidene)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.