(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3-(4-ethoxybenzamido)benzoate
Chemical Structure Depiction of
(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3-(4-ethoxybenzamido)benzoate
(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3-(4-ethoxybenzamido)benzoate
Compound characteristics
| Compound ID: | G357-0650 |
| Compound Name: | (2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3-(4-ethoxybenzamido)benzoate |
| Molecular Weight: | 478.53 |
| Molecular Formula: | C24 H22 N4 O5 S |
| Smiles: | CCC1=NN2C(=NC(COC(c3cccc(c3)NC(c3ccc(cc3)OCC)=O)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.2812 |
| logD: | 4.2745 |
| logSw: | -4.3331 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.518 |
| InChI Key: | LAVVDLRPWQDVQA-UHFFFAOYSA-N |