Phenyl 5-(1,2,3-thiadiazol-4-yl)-2-thiophenesulfonate
TL;DR: Phenyl 5-(1,2,3-thiadiazol-4-yl)-2-thiophenesulfonate (CAS 338400-23-0) is a chemical compound with molecular formula C12H8N2O3S3 and molecular weight 323.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl 5-(thiadiazol-4-yl)thiophene-2-sulfonate
Also Known As: phenyl 5-(1,2,3-thiadiazol-4-yl)-2-thiophenesulfonate, phenyl 5-(thiadiazol-4-yl)thiophene-2-sulfonate, 2M-026, phenyl 5-(1,2,3-thiadiazol-4-yl)thiophene-2-sulfonate, phenyl5-(1,2,3-thiadiazol-4-yl)thiophene-2-sulfonate
| Molecular Formula | C12H8N2O3S3 |
|---|---|
| Molecular Weight | 323.97 g/mol |
| LogP | 3.0343 |
| Topological Polar Surface Area | 69.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 323.9697 |
| Heavy Atoms | 20 |
| Complexity | 795.61224 |
Chemical Identifiers
| CAS Number | 338400-23-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(S2)C3=CSN=N3 |
Product Overview
Phenyl 5-(1,2,3-thiadiazol-4-yl)-2-thiophenesulfonate (CAS 338400-23-0), with molecular formula C12H8N2O3S3 and molecular weight 323.97 g/mol. IUPAC: phenyl 5-(thiadiazol-4-yl)thiophene-2-sulfonate.
Chemical Property Profile of Phenyl 5-(1,2,3-thiadiazol-4-yl)-2-thiophenesulfonate
Property Insights of Phenyl 5-(1,2,3-thiadiazol-4-yl)-2-thiophenesulfonate
The XLogP value of 3.0343 indicates that Phenyl 5-(1,2,3-thiadiazol-4-yl)-2-thiophenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.15 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenyl 5-(1,2,3-thiadiazol-4-yl)-2-thiophenesulfonate. Following Lipinski's Rule of Five, Phenyl 5-(1,2,3-thiadiazol-4-yl)-2-thiophenesulfonate has 0 hydrogen bond donor(s) and 7 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 Phenyl 5-(1,2,3-thiadiazol-4-yl)-2-thiophenesulfonate?
The CAS number of Phenyl 5-(1,2,3-thiadiazol-4-yl)-2-thiophenesulfonate is 338400-23-0.
What is the molecular formula of Phenyl 5-(1,2,3-thiadiazol-4-yl)-2-thiophenesulfonate?
The molecular formula of Phenyl 5-(1,2,3-thiadiazol-4-yl)-2-thiophenesulfonate is C12H8N2O3S3.
What is the molecular weight of Phenyl 5-(1,2,3-thiadiazol-4-yl)-2-thiophenesulfonate?
The molecular weight of Phenyl 5-(1,2,3-thiadiazol-4-yl)-2-thiophenesulfonate is 323.97 g/mol.
Where can I buy Phenyl 5-(1,2,3-thiadiazol-4-yl)-2-thiophenesulfonate?
You can request a quote for Phenyl 5-(1,2,3-thiadiazol-4-yl)-2-thiophenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl 5-(1,2,3-thiadiazol-4-yl)-2-thiophenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for Phenyl 5-(1,2,3-thiadiazol-4-yl)-2-thiophenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.