3-({[4-(4-acetylpiperazin-1-yl)-6-methylpyrimidin-2-yl]sulfanyl}methyl)-N-[(oxolan-2-yl)methyl]benzamide
Chemical Structure Depiction of
3-({[4-(4-acetylpiperazin-1-yl)-6-methylpyrimidin-2-yl]sulfanyl}methyl)-N-[(oxolan-2-yl)methyl]benzamide
3-({[4-(4-acetylpiperazin-1-yl)-6-methylpyrimidin-2-yl]sulfanyl}methyl)-N-[(oxolan-2-yl)methyl]benzamide
Compound characteristics
| Compound ID: | V027-8606 |
| Compound Name: | 3-({[4-(4-acetylpiperazin-1-yl)-6-methylpyrimidin-2-yl]sulfanyl}methyl)-N-[(oxolan-2-yl)methyl]benzamide |
| Molecular Weight: | 469.61 |
| Molecular Formula: | C24 H31 N5 O3 S |
| Salt: | not_available |
| Smiles: | CC(N1CCN(CC1)c1cc(C)nc(n1)SCc1cccc(c1)C(NCC1CCCO1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5195 |
| logD: | 2.5192 |
| logSw: | -2.6933 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.246 |
| InChI Key: | CGXPJZAJDJCZHN-OAQYLSRUSA-N |