N-(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-yl)-3-methylbenzamide
Chemical Structure Depiction of
N-(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-yl)-3-methylbenzamide
N-(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-yl)-3-methylbenzamide
Compound characteristics
| Compound ID: | 8629-0109 |
| Compound Name: | N-(2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-yl)-3-methylbenzamide |
| Molecular Weight: | 342.42 |
| Molecular Formula: | C17 H18 N4 O2 S |
| Smiles: | CCCCC1=NN2C(=NC=C(C2=O)NC(c2cccc(C)c2)=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.1597 |
| logD: | 1.5723 |
| logSw: | -3.2801 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.749 |
| InChI Key: | KAHPOZASZHXAJV-UHFFFAOYSA-N |