6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-2-(4-phenylpiperazin-1-yl)pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-2-(4-phenylpiperazin-1-yl)pyrimidin-4(3H)-one
6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-2-(4-phenylpiperazin-1-yl)pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | Y020-7550 |
| Compound Name: | 6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-2-(4-phenylpiperazin-1-yl)pyrimidin-4(3H)-one |
| Molecular Weight: | 400.52 |
| Molecular Formula: | C18 H20 N6 O S2 |
| Smiles: | Cc1nnc(SCC2=CC(NC(=N2)N2CCN(CC2)c2ccccc2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.276 |
| logD: | 2.2491 |
| logSw: | -2.6765 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.023 |
| InChI Key: | BXLQRNOPLOCYEO-UHFFFAOYSA-N |