2-(4-methylpiperazin-1-yl)-6-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(4-methylpiperazin-1-yl)-6-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}pyrimidin-4(3H)-one
2-(4-methylpiperazin-1-yl)-6-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | Y020-1623 |
| Compound Name: | 2-(4-methylpiperazin-1-yl)-6-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}pyrimidin-4(3H)-one |
| Molecular Weight: | 384.46 |
| Molecular Formula: | C17 H20 N8 O S |
| Smiles: | CN1CCN(CC1)C1NC(C=C(CSc2nnnn2c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1557 |
| logD: | -0.0641 |
| logSw: | -2.1728 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.49 |
| InChI Key: | MZQBSEHMWAPIRN-UHFFFAOYSA-N |