(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 4-[2-(2-chlorophenoxy)acetamido]benzoate
Chemical Structure Depiction of
(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 4-[2-(2-chlorophenoxy)acetamido]benzoate
(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 4-[2-(2-chlorophenoxy)acetamido]benzoate
Compound characteristics
| Compound ID: | G357-0036 |
| Compound Name: | (2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 4-[2-(2-chlorophenoxy)acetamido]benzoate |
| Molecular Weight: | 484.92 |
| Molecular Formula: | C22 H17 Cl N4 O5 S |
| Smiles: | CC1=NN2C(=NC(COC(c3ccc(cc3)NC(COc3ccccc3[Cl])=O)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.7892 |
| logD: | 3.784 |
| logSw: | -4.2309 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.037 |
| InChI Key: | QTUBFPHFZPSMLU-UHFFFAOYSA-N |