{4-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]phenyl}(4-methylpiperazin-1-yl)methanone
Chemical Structure Depiction of
{4-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]phenyl}(4-methylpiperazin-1-yl)methanone
{4-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]phenyl}(4-methylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V003-4646 |
| Compound Name: | {4-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]phenyl}(4-methylpiperazin-1-yl)methanone |
| Molecular Weight: | 546.74 |
| Molecular Formula: | C30 H38 N6 O2 S |
| Salt: | not_available |
| Smiles: | Cc1c(C)nc(nc1N1CCN(CC1)c1ccc(cc1)OC)SCc1ccc(cc1)C(N1CCN(C)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2541 |
| logD: | 4.1234 |
| logSw: | -4.1674 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.151 |
| InChI Key: | QFUPOQHFUMRPHJ-UHFFFAOYSA-N |