2-(azepan-1-yl)-N-[(5-methylfuran-2-yl)methyl]-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
2-(azepan-1-yl)-N-[(5-methylfuran-2-yl)methyl]-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
2-(azepan-1-yl)-N-[(5-methylfuran-2-yl)methyl]-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | G205-1260 |
| Compound Name: | 2-(azepan-1-yl)-N-[(5-methylfuran-2-yl)methyl]-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 387.46 |
| Molecular Formula: | C18 H21 N5 O3 S |
| Smiles: | Cc1ccc(CNC(C2=CN=C3N(C2=O)N=C(N2CCCCCC2)S3)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.6143 |
| logD: | 2.4398 |
| logSw: | -2.9236 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.834 |
| InChI Key: | PPYCQAULCIWYKG-UHFFFAOYSA-N |