4-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]-N-ethyl-N-methylbenzamide
Chemical Structure Depiction of
4-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]-N-ethyl-N-methylbenzamide
4-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]-N-ethyl-N-methylbenzamide
Compound characteristics
| Compound ID: | V003-5316 |
| Compound Name: | 4-[({4-[4-(2-chlorophenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]-N-ethyl-N-methylbenzamide |
| Molecular Weight: | 510.1 |
| Molecular Formula: | C27 H32 Cl N5 O S |
| Salt: | not_available |
| Smiles: | CCN(C)C(c1ccc(CSc2nc(C)c(C)c(n2)N2CCN(CC2)c2ccccc2[Cl])cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4479 |
| logD: | 5.4462 |
| logSw: | -5.8193 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.329 |
| InChI Key: | PONOEXWYUUJRFV-UHFFFAOYSA-N |