Methyl 2-((5-phenyl-1,3,4-oxadiazol-2-yl)thio)acetate
TL;DR: Methyl 2-((5-phenyl-1,3,4-oxadiazol-2-yl)thio)acetate (CAS 140119-09-1) is a chemical compound with molecular formula C11H10N2O3S and molecular weight 250.04121 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate
Also Known As: methyl 2-((5-phenyl-1,3,4-oxadiazol-2-yl)thio)acetate, BAS 03574486, methyl 2-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetate, J1.592.954E, TG2-109-1-2
Technical Specifications
| Molecular Formula | C11H10N2O3S |
| Molecular Weight | 250.04121 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 90.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 250.04121 Da |
| Heavy Atoms | 17 |
| Complexity | 259.0 |
| SMILES | COC(=O)CSC1=NN=C(O1)C2=CC=CC=C2 |
| InChIKey | ISNSOOUQVXOXEI-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 2-((5-phenyl-1,3,4-oxadiazol-2-yl)thio)acetate
Property Insights of Methyl 2-((5-phenyl-1,3,4-oxadiazol-2-yl)thio)acetate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-((5-phenyl-1,3,4-oxadiazol-2-yl)thio)acetate. The TPSA of 90.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-((5-phenyl-1,3,4-oxadiazol-2-yl)thio)acetate. Following Lipinski's Rule of Five, Methyl 2-((5-phenyl-1,3,4-oxadiazol-2-yl)thio)acetate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Methyl 2-((5-phenyl-1,3,4-oxadiazol-2-yl)thio)acetate?
The CAS number of Methyl 2-((5-phenyl-1,3,4-oxadiazol-2-yl)thio)acetate is 140119-09-1.
What is the molecular formula of Methyl 2-((5-phenyl-1,3,4-oxadiazol-2-yl)thio)acetate?
The molecular formula of Methyl 2-((5-phenyl-1,3,4-oxadiazol-2-yl)thio)acetate is C11H10N2O3S.
What is the molecular weight of Methyl 2-((5-phenyl-1,3,4-oxadiazol-2-yl)thio)acetate?
The molecular weight of Methyl 2-((5-phenyl-1,3,4-oxadiazol-2-yl)thio)acetate is 250.04121 g/mol.
Where can I buy Methyl 2-((5-phenyl-1,3,4-oxadiazol-2-yl)thio)acetate?
You can request a quote for Methyl 2-((5-phenyl-1,3,4-oxadiazol-2-yl)thio)acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 2-((5-phenyl-1,3,4-oxadiazol-2-yl)thio)acetate?
Yes, CoreyChem provides custom synthesis services for Methyl 2-((5-phenyl-1,3,4-oxadiazol-2-yl)thio)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.