Butyl 4-methyl-1,2,3-thiadiazol-5-yl sulfone
TL;DR: Butyl 4-methyl-1,2,3-thiadiazol-5-yl sulfone (CAS 338419-85-5) is a chemical compound with molecular formula C7H12N2O2S2 and molecular weight 220.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-butylsulfonyl-4-methylthiadiazole
Also Known As: 5-butylsulfonyl-4-methylthiadiazole, butyl 4-methyl-1,2,3-thiadiazol-5-yl sulfone, 5-butylsulfonyl-4-methyl-thiadiazole, 4G-378S, 5-(butane-1-sulfonyl)-4-methyl-1,2,3-thiadiazole
| Molecular Formula | C7H12N2O2S2 |
|---|---|
| Molecular Weight | 220.03 g/mol |
| LogP | 1.42032 |
| Topological Polar Surface Area | 59.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 220.03403 |
| Heavy Atoms | 13 |
| Complexity | 369.59918 |
Chemical Identifiers
| CAS Number | 338419-85-5 |
|---|---|
| SMILES | CCCCS(=O)(=O)C1=C(N=NS1)C |
Product Overview
Butyl 4-methyl-1,2,3-thiadiazol-5-yl sulfone (CAS 338419-85-5), with molecular formula C7H12N2O2S2 and molecular weight 220.03 g/mol. IUPAC: 5-butylsulfonyl-4-methylthiadiazole.
Chemical Property Profile of Butyl 4-methyl-1,2,3-thiadiazol-5-yl sulfone
Property Insights of Butyl 4-methyl-1,2,3-thiadiazol-5-yl sulfone
The XLogP value of 1.42032 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butyl 4-methyl-1,2,3-thiadiazol-5-yl sulfone. With a topological polar surface area (TPSA) of 59.92 Ų, Butyl 4-methyl-1,2,3-thiadiazol-5-yl sulfone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl 4-methyl-1,2,3-thiadiazol-5-yl sulfone 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 Butyl 4-methyl-1,2,3-thiadiazol-5-yl sulfone?
The CAS number of Butyl 4-methyl-1,2,3-thiadiazol-5-yl sulfone is 338419-85-5.
What is the molecular formula of Butyl 4-methyl-1,2,3-thiadiazol-5-yl sulfone?
The molecular formula of Butyl 4-methyl-1,2,3-thiadiazol-5-yl sulfone is C7H12N2O2S2.
What is the molecular weight of Butyl 4-methyl-1,2,3-thiadiazol-5-yl sulfone?
The molecular weight of Butyl 4-methyl-1,2,3-thiadiazol-5-yl sulfone is 220.03 g/mol.
Where can I buy Butyl 4-methyl-1,2,3-thiadiazol-5-yl sulfone?
You can request a quote for Butyl 4-methyl-1,2,3-thiadiazol-5-yl sulfone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl 4-methyl-1,2,3-thiadiazol-5-yl sulfone?
Yes, KEHONG BIO provides custom synthesis services for Butyl 4-methyl-1,2,3-thiadiazol-5-yl sulfone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.