N-ethyl-4-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]-N-methylbenzamide
Chemical Structure Depiction of
N-ethyl-4-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]-N-methylbenzamide
N-ethyl-4-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]-N-methylbenzamide
Compound characteristics
| Compound ID: | V003-4658 |
| Compound Name: | N-ethyl-4-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]-N-methylbenzamide |
| Molecular Weight: | 505.68 |
| Molecular Formula: | C28 H35 N5 O2 S |
| Salt: | not_available |
| Smiles: | CCN(C)C(c1ccc(CSc2nc(C)c(C)c(n2)N2CCN(CC2)c2ccc(cc2)OC)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8772 |
| logD: | 4.8755 |
| logSw: | -4.5653 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.173 |
| InChI Key: | PTHXCFBUSGDYOE-UHFFFAOYSA-N |