1-(4-{4-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]benzoyl}piperazin-1-yl)ethan-1-one
Chemical Structure Depiction of
1-(4-{4-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]benzoyl}piperazin-1-yl)ethan-1-one
1-(4-{4-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]benzoyl}piperazin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | V003-4622 |
| Compound Name: | 1-(4-{4-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]benzoyl}piperazin-1-yl)ethan-1-one |
| Molecular Weight: | 574.75 |
| Molecular Formula: | C31 H38 N6 O3 S |
| Salt: | not_available |
| Smiles: | CC(N1CCN(CC1)C(c1ccc(CSc2nc(C)c(C)c(n2)N2CCN(CC2)c2ccc(cc2)OC)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0783 |
| logD: | 4.0766 |
| logSw: | -4.1601 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.87 |
| InChI Key: | OCKYDAYRIWTYQV-UHFFFAOYSA-N |