N-benzyl-3-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]benzamide
Chemical Structure Depiction of
N-benzyl-3-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]benzamide
N-benzyl-3-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]benzamide
Compound characteristics
| Compound ID: | V003-5438 |
| Compound Name: | N-benzyl-3-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]benzamide |
| Molecular Weight: | 539.7 |
| Molecular Formula: | C31 H33 N5 O2 S |
| Salt: | not_available |
| Smiles: | Cc1cc(nc(n1)SCc1cccc(c1)C(NCc1ccccc1)=O)N1CCN(CC1)c1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 6.0659 |
| logD: | 6.0655 |
| logSw: | -5.5293 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.2 |
| InChI Key: | YPBJACCWFSOLNN-UHFFFAOYSA-N |