[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-methoxybenzoate
Chemical Structure Depiction of
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-methoxybenzoate
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-methoxybenzoate
Compound characteristics
| Compound ID: | G265-0099 |
| Compound Name: | [5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-methoxybenzoate |
| Molecular Weight: | 359.4 |
| Molecular Formula: | C17 H17 N3 O4 S |
| Smiles: | CC(C)C1=NN2C(=NC(COC(c3ccccc3OC)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.01 |
| logD: | 3.0017 |
| logSw: | -3.5365 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.03 |
| InChI Key: | KEENNZDCXVEVAJ-UHFFFAOYSA-N |