3-phenyl-4-tosylimino-1,3-thiazetidine-2-thione
TL;DR: 3-phenyl-4-tosylimino-1,3-thiazetidine-2-thione (CAS 86702-44-5) is a chemical compound with molecular formula C15H12N2O2S3 and molecular weight 348.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(NZ)-4-methyl-N-(3-phenyl-4-sulfanylidene-1,3-thiazetidin-2-ylidene)benzenesulfonamide
Also Known As: 3-phenyl-4-tosylimino-1,3-thiazetidine-2-thione, 4-Methyl-N-[3-phenyl-4-thioxo-[1,3]thiazetidin-(2Z)-ylidene]-benzenesulfonamide
| Molecular Formula | C15H12N2O2S3 |
|---|---|
| Molecular Weight | 348.01 g/mol |
| LogP | 3.57802 |
| Topological Polar Surface Area | 49.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 348.0061 |
| Heavy Atoms | 22 |
| Complexity | 844.1161 |
Chemical Identifiers
| CAS Number | 86702-44-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)/N=C\2/N(C(=S)S2)C3=CC=CC=C3 |
Product Overview
3-phenyl-4-tosylimino-1,3-thiazetidine-2-thione (CAS 86702-44-5), with molecular formula C15H12N2O2S3 and molecular weight 348.01 g/mol. IUPAC: (NZ)-4-methyl-N-(3-phenyl-4-sulfanylidene-1,3-thiazetidin-2-ylidene)benzenesulfonamide.
Chemical Property Profile of 3-phenyl-4-tosylimino-1,3-thiazetidine-2-thione
Property Insights of 3-phenyl-4-tosylimino-1,3-thiazetidine-2-thione
The XLogP value of 3.57802 indicates that 3-phenyl-4-tosylimino-1,3-thiazetidine-2-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.74 Ų, 3-phenyl-4-tosylimino-1,3-thiazetidine-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-phenyl-4-tosylimino-1,3-thiazetidine-2-thione 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 3-phenyl-4-tosylimino-1,3-thiazetidine-2-thione?
The CAS number of 3-phenyl-4-tosylimino-1,3-thiazetidine-2-thione is 86702-44-5.
What is the molecular formula of 3-phenyl-4-tosylimino-1,3-thiazetidine-2-thione?
The molecular formula of 3-phenyl-4-tosylimino-1,3-thiazetidine-2-thione is C15H12N2O2S3.
What is the molecular weight of 3-phenyl-4-tosylimino-1,3-thiazetidine-2-thione?
The molecular weight of 3-phenyl-4-tosylimino-1,3-thiazetidine-2-thione is 348.01 g/mol.
Where can I buy 3-phenyl-4-tosylimino-1,3-thiazetidine-2-thione?
You can request a quote for 3-phenyl-4-tosylimino-1,3-thiazetidine-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-phenyl-4-tosylimino-1,3-thiazetidine-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 3-phenyl-4-tosylimino-1,3-thiazetidine-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.