6-{[(4-chlorophenyl)sulfanyl]methyl}-2-(4-ethylpiperazin-1-yl)pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-{[(4-chlorophenyl)sulfanyl]methyl}-2-(4-ethylpiperazin-1-yl)pyrimidin-4(3H)-one
6-{[(4-chlorophenyl)sulfanyl]methyl}-2-(4-ethylpiperazin-1-yl)pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | Y020-1610 |
| Compound Name: | 6-{[(4-chlorophenyl)sulfanyl]methyl}-2-(4-ethylpiperazin-1-yl)pyrimidin-4(3H)-one |
| Molecular Weight: | 364.9 |
| Molecular Formula: | C17 H21 Cl N4 O S |
| Smiles: | CCN1CCN(CC1)C1NC(C=C(CSc2ccc(cc2)[Cl])N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8285 |
| logD: | 1.4628 |
| logSw: | -3.4665 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.628 |
| InChI Key: | UGWQJEJUBYVZHO-UHFFFAOYSA-N |