[2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl adamantane-1-carboxylate
Chemical Structure Depiction of
[2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl adamantane-1-carboxylate
[2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl adamantane-1-carboxylate
Compound characteristics
| Compound ID: | G265-0203 |
| Compound Name: | [2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl adamantane-1-carboxylate |
| Molecular Weight: | 401.53 |
| Molecular Formula: | C21 H27 N3 O3 S |
| Smiles: | [H][C@@]12CC3(C[C@@]([H])(C1)C[C@]([H])(C3)C2)C(=O)OCC1=CC(N2C(=N1)SC(CC(C)C)=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9296 |
| logD: | 4.9271 |
| logSw: | -4.6445 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.337 |
| InChI Key: | CAVOROYCPPUCIU-UHFFFAOYSA-N |