7-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}azepan-2-one
Chemical Structure Depiction of
7-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}azepan-2-one
7-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}azepan-2-one
Compound characteristics
| Compound ID: | S515-0043 |
| Compound Name: | 7-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}azepan-2-one |
| Molecular Weight: | 359.42 |
| Molecular Formula: | C19 H25 N3 O4 |
| Smiles: | C1CCC(NC(C1)C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7402 |
| logD: | 0.4639 |
| logSw: | -2.047 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.52 |
| InChI Key: | RUIOKXJYHLQEMY-HNNXBMFYSA-N |