2-({4-[4-(2,5-dimethylphenyl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)-N-[(2-methoxyphenyl)methyl]acetamide
Chemical Structure Depiction of
2-({4-[4-(2,5-dimethylphenyl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)-N-[(2-methoxyphenyl)methyl]acetamide
2-({4-[4-(2,5-dimethylphenyl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)-N-[(2-methoxyphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | M459-5076 |
| Compound Name: | 2-({4-[4-(2,5-dimethylphenyl)piperazin-1-yl]pyrimidin-2-yl}sulfanyl)-N-[(2-methoxyphenyl)methyl]acetamide |
| Molecular Weight: | 477.63 |
| Molecular Formula: | C26 H31 N5 O2 S |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)c1ccnc(n1)SCC(NCc1ccccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5151 |
| logD: | 5.515 |
| logSw: | -5.3811 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.669 |
| InChI Key: | XKVDHWRVYDJQIT-UHFFFAOYSA-N |