3-({[4-(4-acetylpiperazin-1-yl)-6-methylpyrimidin-2-yl]sulfanyl}methyl)-N-benzylbenzamide
Chemical Structure Depiction of
3-({[4-(4-acetylpiperazin-1-yl)-6-methylpyrimidin-2-yl]sulfanyl}methyl)-N-benzylbenzamide
3-({[4-(4-acetylpiperazin-1-yl)-6-methylpyrimidin-2-yl]sulfanyl}methyl)-N-benzylbenzamide
Compound characteristics
| Compound ID: | V003-5439 |
| Compound Name: | 3-({[4-(4-acetylpiperazin-1-yl)-6-methylpyrimidin-2-yl]sulfanyl}methyl)-N-benzylbenzamide |
| Molecular Weight: | 475.61 |
| Molecular Formula: | C26 H29 N5 O2 S |
| Salt: | not_available |
| Smiles: | CC(N1CCN(CC1)c1cc(C)nc(n1)SCc1cccc(c1)C(NCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9689 |
| logD: | 3.9685 |
| logSw: | -3.9878 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.591 |
| InChI Key: | PDWYMOMXSOLJBE-UHFFFAOYSA-N |