7-{[methyl(phenyl)amino]methyl}-2-(2-methylpropyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-{[methyl(phenyl)amino]methyl}-2-(2-methylpropyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-{[methyl(phenyl)amino]methyl}-2-(2-methylpropyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G072-0140 |
| Compound Name: | 7-{[methyl(phenyl)amino]methyl}-2-(2-methylpropyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 328.43 |
| Molecular Formula: | C17 H20 N4 O S |
| Smiles: | CC(C)CC1=NN2C(=NC(CN(C)c3ccccc3)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.3996 |
| logD: | 3.3925 |
| logSw: | -3.757 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.401 |
| InChI Key: | ZDNZLKFCVCKBBN-UHFFFAOYSA-N |