(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3,4,5-triethoxybenzoate
Chemical Structure Depiction of
(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3,4,5-triethoxybenzoate
(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3,4,5-triethoxybenzoate
Compound characteristics
| Compound ID: | G265-0057 |
| Compound Name: | (2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3,4,5-triethoxybenzoate |
| Molecular Weight: | 433.48 |
| Molecular Formula: | C20 H23 N3 O6 S |
| Smiles: | CCOc1cc(cc(c1OCC)OCC)C(=O)OCC1=CC(N2C(=N1)SC(C)=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9194 |
| logD: | 2.9143 |
| logSw: | -3.1251 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 80.29 |
| InChI Key: | URBCTXQHISWZLV-UHFFFAOYSA-N |