2-(4-ethylpiperazin-1-yl)-6-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(4-ethylpiperazin-1-yl)-6-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}pyrimidin-4(3H)-one
2-(4-ethylpiperazin-1-yl)-6-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}pyrimidin-4(3H)-one
Compound characteristics
Compound ID: | Y020-1624 |
Compound Name: | 2-(4-ethylpiperazin-1-yl)-6-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}pyrimidin-4(3H)-one |
Molecular Weight: | 398.49 |
Molecular Formula: | C18 H22 N8 O S |
Smiles: | CCN1CCN(CC1)C1NC(C=C(CSc2nnnn2c2ccccc2)N=1)=O |
Stereo: | ACHIRAL |
logP: | 1.5004 |
logD: | 0.1347 |
logSw: | -2.2525 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 81.55 |
InChI Key: | XOQMRHXCACMHJB-UHFFFAOYSA-N |