(5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoate
TL;DR: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoate (CAS 1111538-66-9) is a chemical compound with molecular formula C19H20N4O3S and molecular weight 384.1256 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoate
Also Known As: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoate, (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-[4,6-dimethyl-2-(methylsulfanyl)pyrimidin-5-yl]propanoate
Technical Specifications
| Molecular Formula | C19H20N4O3S |
| Molecular Weight | 384.1256 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 116.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 384.1256 Da |
| Heavy Atoms | 27 |
| Complexity | 466.0 |
| SMILES | CC1=C(C(=NC(=N1)SC)C)CCC(=O)OCC2=NN=C(O2)C3=CC=CC=C3 |
| InChIKey | WFBFPYZKQQUWPH-UHFFFAOYSA-N |
Chemical Property Profile of (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoate
Property Insights of (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoate
The XLogP value of 3.0 indicates that (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoate. Following Lipinski's Rule of Five, (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoate has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoate?
The CAS number of (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoate is 1111538-66-9.
What is the molecular formula of (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoate?
The molecular formula of (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoate is C19H20N4O3S.
What is the molecular weight of (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoate?
The molecular weight of (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoate is 384.1256 g/mol.
Where can I buy (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoate?
You can request a quote for (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoate?
Yes, CoreyChem provides custom synthesis services for (5-phenyl-1,3,4-oxadiazol-2-yl)methyl 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.