N-[(5-bromo-2-methoxyphenyl)methyl]-2-(4-methylpiperidin-1-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-2-(4-methylpiperidin-1-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
N-[(5-bromo-2-methoxyphenyl)methyl]-2-(4-methylpiperidin-1-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | G205-0461 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-2-(4-methylpiperidin-1-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 492.39 |
| Molecular Formula: | C20 H22 Br N5 O3 S |
| Smiles: | CC1CCN(CC1)C1=NN2C(=NC=C(C(NCc3cc(ccc3OC)[Br])=O)C2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.2846 |
| logD: | 3.1618 |
| logSw: | -3.5863 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.87 |
| InChI Key: | ZWKIUGMWCFEUPW-UHFFFAOYSA-N |