N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-oxo-2-(piperidin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-oxo-2-(piperidin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-oxo-2-(piperidin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | G205-0096 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-oxo-2-(piperidin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 413.45 |
| Molecular Formula: | C19 H19 N5 O4 S |
| Smiles: | C1CCN(CC1)C1=NN2C(=NC=C(C(NCc3ccc4c(c3)OCO4)=O)C2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 1.974 |
| logD: | 1.9692 |
| logSw: | -2.7512 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.355 |
| InChI Key: | BEYBOSBKPVOHLX-UHFFFAOYSA-N |