(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3-(2-methoxybenzamido)benzoate
Chemical Structure Depiction of
(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3-(2-methoxybenzamido)benzoate
(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3-(2-methoxybenzamido)benzoate
Compound characteristics
| Compound ID: | G357-0631 |
| Compound Name: | (2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3-(2-methoxybenzamido)benzoate |
| Molecular Weight: | 464.5 |
| Molecular Formula: | C23 H20 N4 O5 S |
| Smiles: | CCC1=NN2C(=NC(COC(c3cccc(c3)NC(c3ccccc3OC)=O)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.7372 |
| logD: | 3.7259 |
| logSw: | -4.0662 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.025 |
| InChI Key: | VRHUBQCPPLIIKW-UHFFFAOYSA-N |