3-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-[(oxolan-2-yl)methyl]benzamide
Chemical Structure Depiction of
3-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-[(oxolan-2-yl)methyl]benzamide
3-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-[(oxolan-2-yl)methyl]benzamide
Compound characteristics
| Compound ID: | V003-5486 |
| Compound Name: | 3-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-[(oxolan-2-yl)methyl]benzamide |
| Molecular Weight: | 533.69 |
| Molecular Formula: | C29 H35 N5 O3 S |
| Salt: | not_available |
| Smiles: | Cc1cc(nc(n1)SCc1cccc(c1)C(NCC1CCCO1)=O)N1CCN(CC1)c1ccc(cc1)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6165 |
| logD: | 4.6162 |
| logSw: | -4.428 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.854 |
| InChI Key: | HIUCUXIAVYHSAJ-AREMUKBSSA-N |