2-(Methylsulfinoimidoyl)thiophene 2,4,6-trimethylbenzenesulfonate
TL;DR: 2-(Methylsulfinoimidoyl)thiophene 2,4,6-trimethylbenzenesulfonate (CAS 175203-02-8) is a chemical compound with molecular formula C14H19NO3S3 and molecular weight 345.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
imino-methyl-thiophen-2-yl-λ4-sulfane;2,4,6-trimethylbenzenesulfonic acid
Also Known As: imino-methyl-thiophen-2-yl-, 2-(methylsulfinoimidoyl)thiophene 2,4,6-trimethylbenzenesulfonate, I14-35056, imino-methyl-thiophen-2-yl-lambda4-sulfane;2,4,6-trimethylbenzenesulfonic acid, 2-(S-Methylsulfinimidoyl)thiophene 2,4,6-trimethylbenzenesulfonate
| Molecular Formula | C14H19NO3S3 |
|---|---|
| Molecular Weight | 345.05 g/mol |
| LogP | 3.97603 |
| Topological Polar Surface Area | 78.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 345.0527 |
| Heavy Atoms | 21 |
| Complexity | 711.82477 |
Chemical Identifiers
| CAS Number | 175203-02-8 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)S(=O)(=O)O)C.CS(=N)C1=CC=CS1 |
Product Overview
2-(Methylsulfinoimidoyl)thiophene 2,4,6-trimethylbenzenesulfonate (CAS 175203-02-8), with molecular formula C14H19NO3S3 and molecular weight 345.05 g/mol. IUPAC: imino-methyl-thiophen-2-yl-λ4-sulfane;2,4,6-trimethylbenzenesulfonic acid.
Chemical Property Profile of 2-(Methylsulfinoimidoyl)thiophene 2,4,6-trimethylbenzenesulfonate
Property Insights of 2-(Methylsulfinoimidoyl)thiophene 2,4,6-trimethylbenzenesulfonate
The XLogP value of 3.97603 indicates that 2-(Methylsulfinoimidoyl)thiophene 2,4,6-trimethylbenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Methylsulfinoimidoyl)thiophene 2,4,6-trimethylbenzenesulfonate. Following Lipinski's Rule of Five, 2-(Methylsulfinoimidoyl)thiophene 2,4,6-trimethylbenzenesulfonate has 2 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 2-(Methylsulfinoimidoyl)thiophene 2,4,6-trimethylbenzenesulfonate?
The CAS number of 2-(Methylsulfinoimidoyl)thiophene 2,4,6-trimethylbenzenesulfonate is 175203-02-8.
What is the molecular formula of 2-(Methylsulfinoimidoyl)thiophene 2,4,6-trimethylbenzenesulfonate?
The molecular formula of 2-(Methylsulfinoimidoyl)thiophene 2,4,6-trimethylbenzenesulfonate is C14H19NO3S3.
What is the molecular weight of 2-(Methylsulfinoimidoyl)thiophene 2,4,6-trimethylbenzenesulfonate?
The molecular weight of 2-(Methylsulfinoimidoyl)thiophene 2,4,6-trimethylbenzenesulfonate is 345.05 g/mol.
Where can I buy 2-(Methylsulfinoimidoyl)thiophene 2,4,6-trimethylbenzenesulfonate?
You can request a quote for 2-(Methylsulfinoimidoyl)thiophene 2,4,6-trimethylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Methylsulfinoimidoyl)thiophene 2,4,6-trimethylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Methylsulfinoimidoyl)thiophene 2,4,6-trimethylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.