N-[(4-butoxyphenyl)methyl]-5-oxo-2-(pyrrolidin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-[(4-butoxyphenyl)methyl]-5-oxo-2-(pyrrolidin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
N-[(4-butoxyphenyl)methyl]-5-oxo-2-(pyrrolidin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | G205-1007 |
| Compound Name: | N-[(4-butoxyphenyl)methyl]-5-oxo-2-(pyrrolidin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 427.52 |
| Molecular Formula: | C21 H25 N5 O3 S |
| Smiles: | CCCCOc1ccc(CNC(C2=CN=C3N(C2=O)N=C(N2CCCC2)S3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.201 |
| logD: | 3.1859 |
| logSw: | -3.2929 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.024 |
| InChI Key: | RWSBXQNQYGHQQT-UHFFFAOYSA-N |