4-(1,2,3-Thiadiazol-4-yl)phenyl methanesulfonate
TL;DR: 4-(1,2,3-Thiadiazol-4-yl)phenyl methanesulfonate (CAS 337924-69-3) is a chemical compound with molecular formula C9H8N2O3S2 and molecular weight 256.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(thiadiazol-4-yl)phenyl] methanesulfonate
Also Known As: 4-(1,2,3-thiadiazol-4-yl)phenyl methanesulfonate, [4-(thiadiazol-4-yl)phenyl] methanesulfonate, 10L-040, 4-(1,2,3-thiadiazol-4-yl)phenylmethanesulfonate
| Molecular Formula | C9H8N2O3S2 |
|---|---|
| Molecular Weight | 256.00 g/mol |
| LogP | 1.5435 |
| Topological Polar Surface Area | 69.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 255.99763 |
| Heavy Atoms | 16 |
| Complexity | 561.3114 |
Chemical Identifiers
| CAS Number | 337924-69-3 |
|---|---|
| SMILES | CS(=O)(=O)OC1=CC=C(C=C1)C2=CSN=N2 |
Product Overview
4-(1,2,3-Thiadiazol-4-yl)phenyl methanesulfonate (CAS 337924-69-3), with molecular formula C9H8N2O3S2 and molecular weight 256.00 g/mol. IUPAC: [4-(thiadiazol-4-yl)phenyl] methanesulfonate.
Chemical Property Profile of 4-(1,2,3-Thiadiazol-4-yl)phenyl methanesulfonate
Property Insights of 4-(1,2,3-Thiadiazol-4-yl)phenyl methanesulfonate
The XLogP value of 1.5435 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(1,2,3-Thiadiazol-4-yl)phenyl methanesulfonate. The TPSA of 69.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(1,2,3-Thiadiazol-4-yl)phenyl methanesulfonate. Following Lipinski's Rule of Five, 4-(1,2,3-Thiadiazol-4-yl)phenyl methanesulfonate has 0 hydrogen bond donor(s) and 6 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 4-(1,2,3-Thiadiazol-4-yl)phenyl methanesulfonate?
The CAS number of 4-(1,2,3-Thiadiazol-4-yl)phenyl methanesulfonate is 337924-69-3.
What is the molecular formula of 4-(1,2,3-Thiadiazol-4-yl)phenyl methanesulfonate?
The molecular formula of 4-(1,2,3-Thiadiazol-4-yl)phenyl methanesulfonate is C9H8N2O3S2.
What is the molecular weight of 4-(1,2,3-Thiadiazol-4-yl)phenyl methanesulfonate?
The molecular weight of 4-(1,2,3-Thiadiazol-4-yl)phenyl methanesulfonate is 256.00 g/mol.
Where can I buy 4-(1,2,3-Thiadiazol-4-yl)phenyl methanesulfonate?
You can request a quote for 4-(1,2,3-Thiadiazol-4-yl)phenyl methanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1,2,3-Thiadiazol-4-yl)phenyl methanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 4-(1,2,3-Thiadiazol-4-yl)phenyl methanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.