![1,3,4-Thiadiazole, 2-(5-nitro-2-furanyl)-5-[(phenylmethyl)thio]- structure](/static/products/4853/485388-92-9.webp)
1,3,4-Thiadiazole, 2-(5-nitro-2-furanyl)-5-[(phenylmethyl)thio]-
TL;DR: 1,3,4-Thiadiazole, 2-(5-nitro-2-furanyl)-5-[(phenylmethyl)thio]- (CAS 485388-92-9) is a chemical compound with molecular formula C13H9N3O3S2 and molecular weight 319.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfanyl-5-(5-nitrofuran-2-yl)-1,3,4-thiadiazole
Also Known As: 4-(3-Bromobut-3-en-1-yl)bromobenzene, 1,3,4-Thiadiazole, 2-(5-nitro-2-furanyl)-5-[(phenylmethyl)thio]-, 2-benzylsulfanyl-5-(5-nitrofuran-2-yl)-1,3,4-thiadiazole, 2-benzylsulfanyl-5-(5-nitro-2-furyl)-1,3,4-thiadiazole, 2-(BENZYLSULFANYL)-5-(5-NITROFURAN-2-YL)-1,3,4-THIADIAZOLE
| Molecular Formula | C13H9N3O3S2 |
|---|---|
| Molecular Weight | 319.01 g/mol |
| LogP | 3.9986 |
| Topological Polar Surface Area | 82.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 319.00854 |
| Heavy Atoms | 21 |
| Complexity | 754.87946 |
Chemical Identifiers
| CAS Number | 485388-92-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSC2=NN=C(S2)C3=CC=C(O3)[N+](=O)[O-] |
Product Overview
1,3,4-Thiadiazole, 2-(5-nitro-2-furanyl)-5-[(phenylmethyl)thio]- (CAS 485388-92-9), with molecular formula C13H9N3O3S2 and molecular weight 319.01 g/mol. IUPAC: 2-benzylsulfanyl-5-(5-nitrofuran-2-yl)-1,3,4-thiadiazole.
Chemical Property Profile of 1,3,4-Thiadiazole, 2-(5-nitro-2-furanyl)-5-[(phenylmethyl)thio]-
Property Insights of 1,3,4-Thiadiazole, 2-(5-nitro-2-furanyl)-5-[(phenylmethyl)thio]-
The XLogP value of 3.9986 indicates that 1,3,4-Thiadiazole, 2-(5-nitro-2-furanyl)-5-[(phenylmethyl)thio]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,4-Thiadiazole, 2-(5-nitro-2-furanyl)-5-[(phenylmethyl)thio]-. Following Lipinski's Rule of Five, 1,3,4-Thiadiazole, 2-(5-nitro-2-furanyl)-5-[(phenylmethyl)thio]- 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 1,3,4-Thiadiazole, 2-(5-nitro-2-furanyl)-5-[(phenylmethyl)thio]-?
The CAS number of 1,3,4-Thiadiazole, 2-(5-nitro-2-furanyl)-5-[(phenylmethyl)thio]- is 485388-92-9.
What is the molecular formula of 1,3,4-Thiadiazole, 2-(5-nitro-2-furanyl)-5-[(phenylmethyl)thio]-?
The molecular formula of 1,3,4-Thiadiazole, 2-(5-nitro-2-furanyl)-5-[(phenylmethyl)thio]- is C13H9N3O3S2.
What is the molecular weight of 1,3,4-Thiadiazole, 2-(5-nitro-2-furanyl)-5-[(phenylmethyl)thio]-?
The molecular weight of 1,3,4-Thiadiazole, 2-(5-nitro-2-furanyl)-5-[(phenylmethyl)thio]- is 319.01 g/mol.
Where can I buy 1,3,4-Thiadiazole, 2-(5-nitro-2-furanyl)-5-[(phenylmethyl)thio]-?
You can request a quote for 1,3,4-Thiadiazole, 2-(5-nitro-2-furanyl)-5-[(phenylmethyl)thio]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,4-Thiadiazole, 2-(5-nitro-2-furanyl)-5-[(phenylmethyl)thio]-?
Yes, KEHONG BIO provides custom synthesis services for 1,3,4-Thiadiazole, 2-(5-nitro-2-furanyl)-5-[(phenylmethyl)thio]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.