(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 4-(4-chlorobenzamido)benzoate
Chemical Structure Depiction of
(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 4-(4-chlorobenzamido)benzoate
(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 4-(4-chlorobenzamido)benzoate
Compound characteristics
| Compound ID: | G357-0502 |
| Compound Name: | (2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 4-(4-chlorobenzamido)benzoate |
| Molecular Weight: | 468.92 |
| Molecular Formula: | C22 H17 Cl N4 O4 S |
| Smiles: | CCC1=NN2C(=NC(COC(c3ccc(cc3)NC(c3ccc(cc3)[Cl])=O)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.3263 |
| logD: | 4.2921 |
| logSw: | -4.5876 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.395 |
| InChI Key: | KDNOFXMTTIVFNH-UHFFFAOYSA-N |