[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl N-(4-tert-butylbenzoyl)glycinate
Chemical Structure Depiction of
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl N-(4-tert-butylbenzoyl)glycinate
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl N-(4-tert-butylbenzoyl)glycinate
Compound characteristics
Compound ID: | G264-0373 |
Compound Name: | [5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl N-(4-tert-butylbenzoyl)glycinate |
Molecular Weight: | 442.54 |
Molecular Formula: | C22 H26 N4 O4 S |
Smiles: | CC(C)C1=NN2C(=NC(COC(CNC(c3ccc(cc3)C(C)(C)C)=O)=O)=CC2=O)S1 |
Stereo: | ACHIRAL |
logP: | 4.0619 |
logD: | 4.0536 |
logSw: | -4.1408 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 83.49 |
InChI Key: | FUPQEPMLBBJKEG-UHFFFAOYSA-N |