N-[2-(2H-1,3-benzodioxol-5-yl)-2-(4-phenylpiperazin-1-yl)ethyl]-3-methylbenzamide
Chemical Structure Depiction of
N-[2-(2H-1,3-benzodioxol-5-yl)-2-(4-phenylpiperazin-1-yl)ethyl]-3-methylbenzamide
N-[2-(2H-1,3-benzodioxol-5-yl)-2-(4-phenylpiperazin-1-yl)ethyl]-3-methylbenzamide
Compound characteristics
| Compound ID: | G856-4231 |
| Compound Name: | N-[2-(2H-1,3-benzodioxol-5-yl)-2-(4-phenylpiperazin-1-yl)ethyl]-3-methylbenzamide |
| Molecular Weight: | 443.55 |
| Molecular Formula: | C27 H29 N3 O3 |
| Smiles: | Cc1cccc(c1)C(NCC(c1ccc2c(c1)OCO2)N1CCN(CC1)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4875 |
| logD: | 4.46 |
| logSw: | -4.2866 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.017 |
| InChI Key: | HTMDKTISOJPFOD-DEOSSOPVSA-N |