1-benzyl-7-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]azepan-2-one
Chemical Structure Depiction of
1-benzyl-7-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]azepan-2-one
1-benzyl-7-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]azepan-2-one
Compound characteristics
| Compound ID: | S513-0644 |
| Compound Name: | 1-benzyl-7-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]azepan-2-one |
| Molecular Weight: | 393.49 |
| Molecular Formula: | C22 H27 N5 O2 |
| Smiles: | C1CCC(N(Cc2ccccc2)C(C1)C(N1CCN(CC1)c1ncccn1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2284 |
| logD: | 2.2284 |
| logSw: | -2.2843 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.25 |
| InChI Key: | WUBJCSJAXIHQAK-IBGZPJMESA-N |