7-[(4-ethylphenoxy)methyl]-2-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-[(4-ethylphenoxy)methyl]-2-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-[(4-ethylphenoxy)methyl]-2-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | C679-2774 |
| Compound Name: | 7-[(4-ethylphenoxy)methyl]-2-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 301.36 |
| Molecular Formula: | C15 H15 N3 O2 S |
| Smiles: | CCc1ccc(cc1)OCC1=CC(N2C(=N1)SC(C)=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.199 |
| logD: | 3.1939 |
| logSw: | -3.2419 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.943 |
| InChI Key: | PVJAWVPXYZPDFE-UHFFFAOYSA-N |