2-(4-methylpiperazin-1-yl)-6-{[(pyrimidin-2-yl)sulfanyl]methyl}pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(4-methylpiperazin-1-yl)-6-{[(pyrimidin-2-yl)sulfanyl]methyl}pyrimidin-4(3H)-one
2-(4-methylpiperazin-1-yl)-6-{[(pyrimidin-2-yl)sulfanyl]methyl}pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | Y020-2393 |
| Compound Name: | 2-(4-methylpiperazin-1-yl)-6-{[(pyrimidin-2-yl)sulfanyl]methyl}pyrimidin-4(3H)-one |
| Molecular Weight: | 318.4 |
| Molecular Formula: | C14 H18 N6 O S |
| Smiles: | CN1CCN(CC1)C1NC(C=C(CSc2ncccn2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.2205 |
| logD: | -0.9992 |
| logSw: | -2.2734 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.725 |
| InChI Key: | XYYVHNWSSSMCMR-UHFFFAOYSA-N |