N-{[2-(2-chlorophenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}-3-fluoro-4-methylbenzamide
Chemical Structure Depiction of
N-{[2-(2-chlorophenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}-3-fluoro-4-methylbenzamide
N-{[2-(2-chlorophenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}-3-fluoro-4-methylbenzamide
Compound characteristics
| Compound ID: | F527-0681 |
| Compound Name: | N-{[2-(2-chlorophenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}-3-fluoro-4-methylbenzamide |
| Molecular Weight: | 428.87 |
| Molecular Formula: | C20 H14 Cl F N4 O2 S |
| Smiles: | Cc1ccc(cc1F)C(NCC1=CC(N2C(=N1)SC(c1ccccc1[Cl])=N2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8827 |
| logD: | 3.8822 |
| logSw: | -4.3217 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.684 |
| InChI Key: | ZIDRSPRRCJCKMG-UHFFFAOYSA-N |