2-cyclohexyl-7-{[methyl(phenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-cyclohexyl-7-{[methyl(phenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-cyclohexyl-7-{[methyl(phenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G072-0785 |
| Compound Name: | 2-cyclohexyl-7-{[methyl(phenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 354.47 |
| Molecular Formula: | C19 H22 N4 O S |
| Smiles: | CN(CC1=CC(N2C(=N1)SC(C1CCCCC1)=N2)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9993 |
| logD: | 3.9989 |
| logSw: | -4.0993 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.417 |
| InChI Key: | VACJPZGBMFJNEO-UHFFFAOYSA-N |