[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-chlorobenzoate
Chemical Structure Depiction of
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-chlorobenzoate
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-chlorobenzoate
Compound characteristics
| Compound ID: | G265-0070 |
| Compound Name: | [5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-chlorobenzoate |
| Molecular Weight: | 363.82 |
| Molecular Formula: | C16 H14 Cl N3 O3 S |
| Smiles: | CC(C)C1=NN2C(=NC(COC(c3ccccc3[Cl])=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.6838 |
| logD: | 3.6755 |
| logSw: | -4.0214 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.4 |
| InChI Key: | DYTQEVYFGPWUAO-UHFFFAOYSA-N |