7-{[benzyl(2-methylpropyl)amino]methyl}-2-tert-butyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-{[benzyl(2-methylpropyl)amino]methyl}-2-tert-butyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-{[benzyl(2-methylpropyl)amino]methyl}-2-tert-butyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G768-1958 |
| Compound Name: | 7-{[benzyl(2-methylpropyl)amino]methyl}-2-tert-butyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 384.54 |
| Molecular Formula: | C21 H28 N4 O S |
| Smiles: | CC(C)CN(CC1=CC(N2C(=N1)SC(C(C)(C)C)=N2)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1796 |
| logD: | 3.863 |
| logSw: | -4.169 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.254 |
| InChI Key: | PLQWPDFKUXQGJJ-UHFFFAOYSA-N |