2-ethyl-7-{[ethyl(3-methylphenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-ethyl-7-{[ethyl(3-methylphenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-ethyl-7-{[ethyl(3-methylphenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G072-0103 |
| Compound Name: | 2-ethyl-7-{[ethyl(3-methylphenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 328.43 |
| Molecular Formula: | C17 H20 N4 O S |
| Smiles: | CCC1=NN2C(=NC(CN(CC)c3cccc(C)c3)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.5434 |
| logD: | 3.5252 |
| logSw: | -3.5957 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.186 |
| InChI Key: | PEYGMQZAKGZOEP-UHFFFAOYSA-N |