2-cyclohexyl-7-{[methyl(3-methylphenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-cyclohexyl-7-{[methyl(3-methylphenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-cyclohexyl-7-{[methyl(3-methylphenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G072-0790 |
| Compound Name: | 2-cyclohexyl-7-{[methyl(3-methylphenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 368.5 |
| Molecular Formula: | C20 H24 N4 O S |
| Smiles: | Cc1cccc(c1)N(C)CC1=CC(N2C(=N1)SC(C1CCCCC1)=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5487 |
| logD: | 4.5483 |
| logSw: | -4.3824 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.417 |
| InChI Key: | NNVWEPLZIZQYPV-UHFFFAOYSA-N |