[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 4-ethoxybenzoate
Chemical Structure Depiction of
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 4-ethoxybenzoate
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 4-ethoxybenzoate
Compound characteristics
| Compound ID: | G265-0117 |
| Compound Name: | [5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 4-ethoxybenzoate |
| Molecular Weight: | 373.43 |
| Molecular Formula: | C18 H19 N3 O4 S |
| Smiles: | CCOc1ccc(cc1)C(=O)OCC1=CC(N2C(=N1)SC(C(C)C)=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7238 |
| logD: | 3.7155 |
| logSw: | -3.9646 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.523 |
| InChI Key: | KZWINCQXRWNWIL-UHFFFAOYSA-N |