N-[(2,5-dimethylphenyl)methyl]-5-oxo-2-(pyrrolidin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-[(2,5-dimethylphenyl)methyl]-5-oxo-2-(pyrrolidin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
N-[(2,5-dimethylphenyl)methyl]-5-oxo-2-(pyrrolidin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | C796-0854 |
| Compound Name: | N-[(2,5-dimethylphenyl)methyl]-5-oxo-2-(pyrrolidin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 383.47 |
| Molecular Formula: | C19 H21 N5 O2 S |
| Smiles: | Cc1ccc(C)c(CNC(C2=CN=C3N(C2=O)N=C(N2CCCC2)S3)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.084 |
| logD: | 2.6617 |
| logSw: | -3.1548 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.606 |
| InChI Key: | SXDPYWQOMCXNIX-UHFFFAOYSA-N |