N-{2-(2H-1,3-benzodioxol-5-yl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl}-3,4-difluorobenzamide
Chemical Structure Depiction of
N-{2-(2H-1,3-benzodioxol-5-yl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl}-3,4-difluorobenzamide
N-{2-(2H-1,3-benzodioxol-5-yl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl}-3,4-difluorobenzamide
Compound characteristics
| Compound ID: | G856-4247 |
| Compound Name: | N-{2-(2H-1,3-benzodioxol-5-yl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl}-3,4-difluorobenzamide |
| Molecular Weight: | 495.53 |
| Molecular Formula: | C27 H27 F2 N3 O4 |
| Smiles: | COc1ccc(cc1)N1CCN(CC1)C(CNC(c1ccc(c(c1)F)F)=O)c1ccc2c(c1)OCO2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5968 |
| logD: | 4.568 |
| logSw: | -4.3894 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.561 |
| InChI Key: | XUWOCFINZHXOMX-DEOSSOPVSA-N |