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2-[(2-Phenyl-1,3-oxazol-5-yl)methylsulfanyl]-1,3-benzoxazole
TL;DR: 2-[(2-Phenyl-1,3-oxazol-5-yl)methylsulfanyl]-1,3-benzoxazole (CAS 312271-61-7) is a chemical compound with molecular formula C17H12N2O2S and molecular weight 308.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-phenyl-1,3-oxazol-5-yl)methylsulfanyl]-1,3-benzoxazole
Also Known As: 2-[(2-phenyl-1,3-oxazol-5-yl)methylthio]benzoxazole, 2-[(2-phenyl-1,3-oxazol-5-yl)methylsulfanyl]-1,3-benzoxazole, 2-{[(2-phenyl-1,3-oxazol-5-yl)methyl]sulfanyl}-1,3-benzoxazole, 1,3-BENZOXAZOL-2-YL [(2-PHENYL-1,3-OXAZOL-5-YL)METHYL] SULFIDE
| Molecular Formula | C17H12N2O2S |
|---|---|
| Molecular Weight | 308.06 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 77.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.06195 |
| Heavy Atoms | 22 |
| Complexity | 365.0 |
Chemical Identifiers
| CAS Number | 312271-61-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC=C(O2)CSC3=NC4=CC=CC=C4O3 |
| InChIKey | HAEVMXLVKJENRU-UHFFFAOYSA-N |
Product Overview
2-[(2-Phenyl-1,3-oxazol-5-yl)methylsulfanyl]-1,3-benzoxazole (CAS 312271-61-7), with molecular formula C17H12N2O2S and molecular weight 308.06 g/mol. IUPAC: 2-[(2-phenyl-1,3-oxazol-5-yl)methylsulfanyl]-1,3-benzoxazole.
Chemical Property Profile of 2-[(2-Phenyl-1,3-oxazol-5-yl)methylsulfanyl]-1,3-benzoxazole
Property Insights of 2-[(2-Phenyl-1,3-oxazol-5-yl)methylsulfanyl]-1,3-benzoxazole
The XLogP value of 4.2 indicates that 2-[(2-Phenyl-1,3-oxazol-5-yl)methylsulfanyl]-1,3-benzoxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2-Phenyl-1,3-oxazol-5-yl)methylsulfanyl]-1,3-benzoxazole. Following Lipinski's Rule of Five, 2-[(2-Phenyl-1,3-oxazol-5-yl)methylsulfanyl]-1,3-benzoxazole 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 2-[(2-Phenyl-1,3-oxazol-5-yl)methylsulfanyl]-1,3-benzoxazole?
The CAS number of 2-[(2-Phenyl-1,3-oxazol-5-yl)methylsulfanyl]-1,3-benzoxazole is 312271-61-7.
What is the molecular formula of 2-[(2-Phenyl-1,3-oxazol-5-yl)methylsulfanyl]-1,3-benzoxazole?
The molecular formula of 2-[(2-Phenyl-1,3-oxazol-5-yl)methylsulfanyl]-1,3-benzoxazole is C17H12N2O2S.
What is the molecular weight of 2-[(2-Phenyl-1,3-oxazol-5-yl)methylsulfanyl]-1,3-benzoxazole?
The molecular weight of 2-[(2-Phenyl-1,3-oxazol-5-yl)methylsulfanyl]-1,3-benzoxazole is 308.06 g/mol.
Where can I buy 2-[(2-Phenyl-1,3-oxazol-5-yl)methylsulfanyl]-1,3-benzoxazole?
You can request a quote for 2-[(2-Phenyl-1,3-oxazol-5-yl)methylsulfanyl]-1,3-benzoxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2-Phenyl-1,3-oxazol-5-yl)methylsulfanyl]-1,3-benzoxazole?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2-Phenyl-1,3-oxazol-5-yl)methylsulfanyl]-1,3-benzoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.