2-(4-methylpiperazin-1-yl)-6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(4-methylpiperazin-1-yl)-6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}pyrimidin-4(3H)-one
2-(4-methylpiperazin-1-yl)-6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | Y020-1615 |
| Compound Name: | 2-(4-methylpiperazin-1-yl)-6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}pyrimidin-4(3H)-one |
| Molecular Weight: | 338.45 |
| Molecular Formula: | C13 H18 N6 O S2 |
| Smiles: | Cc1nnc(SCC2=CC(NC(=N2)N2CCN(C)CC2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 0.4588 |
| logD: | -0.7609 |
| logSw: | -2.0618 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.239 |
| InChI Key: | SERDUVKJMOXJLH-UHFFFAOYSA-N |