7-{[{[4-(propan-2-yl)phenyl]methyl}(propyl)amino]methyl}-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-{[{[4-(propan-2-yl)phenyl]methyl}(propyl)amino]methyl}-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-{[{[4-(propan-2-yl)phenyl]methyl}(propyl)amino]methyl}-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G768-3628 |
| Compound Name: | 7-{[{[4-(propan-2-yl)phenyl]methyl}(propyl)amino]methyl}-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 398.57 |
| Molecular Formula: | C22 H30 N4 O S |
| Smiles: | CCCC1=NN2C(=NC(CN(CCC)Cc3ccc(cc3)C(C)C)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 5.1378 |
| logD: | 4.4781 |
| logSw: | -4.8878 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.136 |
| InChI Key: | FPXYLJFAHFGSDC-UHFFFAOYSA-N |