[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-(4-methoxybenzamido)benzoate
Chemical Structure Depiction of
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-(4-methoxybenzamido)benzoate
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-(4-methoxybenzamido)benzoate
Compound characteristics
| Compound ID: | G357-0466 |
| Compound Name: | [5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-(4-methoxybenzamido)benzoate |
| Molecular Weight: | 478.53 |
| Molecular Formula: | C24 H22 N4 O5 S |
| Smiles: | CC(C)C1=NN2C(=NC(COC(c3ccccc3NC(c3ccc(cc3)OC)=O)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.0333 |
| logD: | 3.897 |
| logSw: | -4.3734 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.337 |
| InChI Key: | YBGVYIVBLBRUQJ-UHFFFAOYSA-N |