N-[2-(dimethylamino)ethyl]-3-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]benzamide
Chemical Structure Depiction of
N-[2-(dimethylamino)ethyl]-3-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]benzamide
N-[2-(dimethylamino)ethyl]-3-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]benzamide
Compound characteristics
| Compound ID: | V003-5474 |
| Compound Name: | N-[2-(dimethylamino)ethyl]-3-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]benzamide |
| Molecular Weight: | 520.7 |
| Molecular Formula: | C28 H36 N6 O2 S |
| Salt: | not_available |
| Smiles: | Cc1cc(nc(n1)SCc1cccc(c1)C(NCCN(C)C)=O)N1CCN(CC1)c1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.4017 |
| logD: | 3.5624 |
| logSw: | -4.2936 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.179 |
| InChI Key: | XDMBTJGTABADQI-UHFFFAOYSA-N |