2-ethyl-7-{[methyl(phenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-ethyl-7-{[methyl(phenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-ethyl-7-{[methyl(phenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G072-0097 |
| Compound Name: | 2-ethyl-7-{[methyl(phenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 300.38 |
| Molecular Formula: | C15 H16 N4 O S |
| Smiles: | CCC1=NN2C(=NC(CN(C)c3ccccc3)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 2.5538 |
| logD: | 2.5356 |
| logSw: | -2.6163 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.401 |
| InChI Key: | VSVIBFQKPVSAFQ-UHFFFAOYSA-N |