[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-[2-(4-methylphenoxy)acetamido]benzoate
Chemical Structure Depiction of
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-[2-(4-methylphenoxy)acetamido]benzoate
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-[2-(4-methylphenoxy)acetamido]benzoate
Compound characteristics
| Compound ID: | G357-0446 |
| Compound Name: | [5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-[2-(4-methylphenoxy)acetamido]benzoate |
| Molecular Weight: | 492.55 |
| Molecular Formula: | C25 H24 N4 O5 S |
| Smiles: | CC(C)C1=NN2C(=NC(COC(c3ccccc3NC(COc3ccc(C)cc3)=O)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.3104 |
| logD: | 4.2917 |
| logSw: | -4.404 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.079 |
| InChI Key: | RSLYHTYMNIZBRX-UHFFFAOYSA-N |