2-{[6-methyl-2-(4-methylphenyl)pyrimidin-4-yl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-{[6-methyl-2-(4-methylphenyl)pyrimidin-4-yl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethan-1-one
2-{[6-methyl-2-(4-methylphenyl)pyrimidin-4-yl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | M181-0722 |
| Compound Name: | 2-{[6-methyl-2-(4-methylphenyl)pyrimidin-4-yl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethan-1-one |
| Molecular Weight: | 418.56 |
| Molecular Formula: | C24 H26 N4 O S |
| Smiles: | Cc1ccc(cc1)c1nc(C)cc(n1)SCC(N1CCN(CC1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0659 |
| logD: | 5.0614 |
| logSw: | -4.7407 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.087 |
| InChI Key: | ZRCAHILTYYTFMQ-UHFFFAOYSA-N |