N-[(3,4-dimethoxyphenyl)methyl]-5-oxo-2-(pyrrolidin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-[(3,4-dimethoxyphenyl)methyl]-5-oxo-2-(pyrrolidin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
N-[(3,4-dimethoxyphenyl)methyl]-5-oxo-2-(pyrrolidin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | G205-0970 |
| Compound Name: | N-[(3,4-dimethoxyphenyl)methyl]-5-oxo-2-(pyrrolidin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 415.47 |
| Molecular Formula: | C19 H21 N5 O4 S |
| Smiles: | COc1ccc(CNC(C2=CN=C3N(C2=O)N=C(N2CCCC2)S3)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.3836 |
| logD: | 1.3779 |
| logSw: | -2.4938 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.867 |
| InChI Key: | XEAGEMPVSSIQGU-UHFFFAOYSA-N |