![4-phenyl-2-[(phenylmethyl)thio]Thiazole structure](/static/products/7609/76098-78-7.webp)
4-phenyl-2-[(phenylmethyl)thio]Thiazole
TL;DR: 4-phenyl-2-[(phenylmethyl)thio]Thiazole (CAS 76098-78-7) is a chemical compound with molecular formula C16H13NS2 and molecular weight 283.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfanyl-4-phenyl-1,3-thiazole
Also Known As: 4-phenyl-2-[(phenylmethyl)thio]Thiazole, 2-(Benzylthio)-4-phenylthiazole, 2-benzylsulfanyl-4-phenyl-1,3-thiazole, 2-(benzylsulfanyl)-4-phenyl-1,3-thiazole, 4-phenyl-2-(phenylmethylthio)-1,3-thiazole
| Molecular Formula | C16H13NS2 |
|---|---|
| Molecular Weight | 283.05 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 283.04895 |
| Heavy Atoms | 19 |
| Complexity | 259.0 |
Chemical Identifiers
| CAS Number | 76098-78-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSC2=NC(=CS2)C3=CC=CC=C3 |
| InChIKey | AZMIOEUPQDHRPA-UHFFFAOYSA-N |
Product Overview
4-phenyl-2-[(phenylmethyl)thio]Thiazole (CAS 76098-78-7), with molecular formula C16H13NS2 and molecular weight 283.05 g/mol. IUPAC: 2-benzylsulfanyl-4-phenyl-1,3-thiazole.
Chemical Property Profile of 4-phenyl-2-[(phenylmethyl)thio]Thiazole
Property Insights of 4-phenyl-2-[(phenylmethyl)thio]Thiazole
The XLogP value of 5.0 indicates that 4-phenyl-2-[(phenylmethyl)thio]Thiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-phenyl-2-[(phenylmethyl)thio]Thiazole. Following Lipinski's Rule of Five, 4-phenyl-2-[(phenylmethyl)thio]Thiazole has 0 hydrogen bond donor(s) and 3 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-phenyl-2-[(phenylmethyl)thio]Thiazole?
The CAS number of 4-phenyl-2-[(phenylmethyl)thio]Thiazole is 76098-78-7.
What is the molecular formula of 4-phenyl-2-[(phenylmethyl)thio]Thiazole?
The molecular formula of 4-phenyl-2-[(phenylmethyl)thio]Thiazole is C16H13NS2.
What is the molecular weight of 4-phenyl-2-[(phenylmethyl)thio]Thiazole?
The molecular weight of 4-phenyl-2-[(phenylmethyl)thio]Thiazole is 283.05 g/mol.
Where can I buy 4-phenyl-2-[(phenylmethyl)thio]Thiazole?
You can request a quote for 4-phenyl-2-[(phenylmethyl)thio]Thiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-phenyl-2-[(phenylmethyl)thio]Thiazole?
Yes, KEHONG BIO provides custom synthesis services for 4-phenyl-2-[(phenylmethyl)thio]Thiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.