Allyl 4-phenyl-1,2,3-thiadiazol-5-yl sulfide
TL;DR: Allyl 4-phenyl-1,2,3-thiadiazol-5-yl sulfide (CAS 338409-00-0) is a chemical compound with molecular formula C11H10N2S2 and molecular weight 234.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-phenyl-5-prop-2-enylsulfanylthiadiazole
Also Known As: 4-phenyl-5-prop-2-enylsulfanylthiadiazole, allyl 4-phenyl-1,2,3-thiadiazol-5-yl sulfide, 3H-388S, 4-phenyl-5-prop-2-enylsulfanyl-thiadiazole, 4-phenyl-5-(prop-2-en-1-ylsulfanyl)-1,2,3-thiadiazole
| Molecular Formula | C11H10N2S2 |
|---|---|
| Molecular Weight | 234.03 g/mol |
| LogP | 3.4832 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 234.02853 |
| Heavy Atoms | 15 |
| Complexity | 436.8584 |
Chemical Identifiers
| CAS Number | 338409-00-0 |
|---|---|
| SMILES | C=CCSC1=C(N=NS1)C2=CC=CC=C2 |
Product Overview
Allyl 4-phenyl-1,2,3-thiadiazol-5-yl sulfide (CAS 338409-00-0), with molecular formula C11H10N2S2 and molecular weight 234.03 g/mol. IUPAC: 4-phenyl-5-prop-2-enylsulfanylthiadiazole.
Chemical Property Profile of Allyl 4-phenyl-1,2,3-thiadiazol-5-yl sulfide
Property Insights of Allyl 4-phenyl-1,2,3-thiadiazol-5-yl sulfide
The XLogP value of 3.4832 indicates that Allyl 4-phenyl-1,2,3-thiadiazol-5-yl sulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.78 Ų, Allyl 4-phenyl-1,2,3-thiadiazol-5-yl sulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Allyl 4-phenyl-1,2,3-thiadiazol-5-yl sulfide 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 Allyl 4-phenyl-1,2,3-thiadiazol-5-yl sulfide?
The CAS number of Allyl 4-phenyl-1,2,3-thiadiazol-5-yl sulfide is 338409-00-0.
What is the molecular formula of Allyl 4-phenyl-1,2,3-thiadiazol-5-yl sulfide?
The molecular formula of Allyl 4-phenyl-1,2,3-thiadiazol-5-yl sulfide is C11H10N2S2.
What is the molecular weight of Allyl 4-phenyl-1,2,3-thiadiazol-5-yl sulfide?
The molecular weight of Allyl 4-phenyl-1,2,3-thiadiazol-5-yl sulfide is 234.03 g/mol.
Where can I buy Allyl 4-phenyl-1,2,3-thiadiazol-5-yl sulfide?
You can request a quote for Allyl 4-phenyl-1,2,3-thiadiazol-5-yl sulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Allyl 4-phenyl-1,2,3-thiadiazol-5-yl sulfide?
Yes, KEHONG BIO provides custom synthesis services for Allyl 4-phenyl-1,2,3-thiadiazol-5-yl sulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.