N-[(3,4-dimethoxyphenyl)methyl]-2-(4-methylpiperidin-1-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-[(3,4-dimethoxyphenyl)methyl]-2-(4-methylpiperidin-1-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
N-[(3,4-dimethoxyphenyl)methyl]-2-(4-methylpiperidin-1-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | G205-0457 |
| Compound Name: | N-[(3,4-dimethoxyphenyl)methyl]-2-(4-methylpiperidin-1-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 443.52 |
| Molecular Formula: | C21 H25 N5 O4 S |
| Smiles: | CC1CCN(CC1)C1=NN2C(=NC=C(C(NCc3ccc(c(c3)OC)OC)=O)C2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 2.0062 |
| logD: | 2.0016 |
| logSw: | -2.6972 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.501 |
| InChI Key: | JFIVMWZSIUNIER-UHFFFAOYSA-N |