(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-(2-phenoxypropanamido)benzoate
Chemical Structure Depiction of
(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-(2-phenoxypropanamido)benzoate
(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-(2-phenoxypropanamido)benzoate
Compound characteristics
| Compound ID: | G357-0209 |
| Compound Name: | (2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-(2-phenoxypropanamido)benzoate |
| Molecular Weight: | 464.5 |
| Molecular Formula: | C23 H20 N4 O5 S |
| Smiles: | CC(C(Nc1ccccc1C(=O)OCC1=CC(N2C(=N1)SC(C)=N2)=O)=O)Oc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.516 |
| logD: | 3.4926 |
| logSw: | -3.8267 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.756 |
| InChI Key: | CCFHWUBDOSTKLZ-AWEZNQCLSA-N |