(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl (4-chlorophenoxy)acetate
Chemical Structure Depiction of
(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl (4-chlorophenoxy)acetate
(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl (4-chlorophenoxy)acetate
Compound characteristics
| Compound ID: | G265-0899 |
| Compound Name: | (5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl (4-chlorophenoxy)acetate |
| Molecular Weight: | 393.85 |
| Molecular Formula: | C17 H16 Cl N3 O4 S |
| Smiles: | CCCC1=NN2C(=NC(COC(COc3ccc(cc3)[Cl])=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.3416 |
| logD: | 3.3375 |
| logSw: | -3.6489 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.208 |
| InChI Key: | IBVDIQBOTDPIOU-UHFFFAOYSA-N |