7-{[benzyl(methyl)amino]methyl}-2-(pentan-3-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-{[benzyl(methyl)amino]methyl}-2-(pentan-3-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-{[benzyl(methyl)amino]methyl}-2-(pentan-3-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G072-0281 |
| Compound Name: | 7-{[benzyl(methyl)amino]methyl}-2-(pentan-3-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 356.49 |
| Molecular Formula: | C19 H24 N4 O S |
| Smiles: | CCC(CC)C1=NN2C(=NC(CN(C)Cc3ccccc3)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.8256 |
| logD: | 3.5975 |
| logSw: | -3.9145 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.386 |
| InChI Key: | MWGNKOHTHVVJEV-UHFFFAOYSA-N |