N-{2-(2H-1,3-benzodioxol-5-yl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl}-3-methylbenzamide
Chemical Structure Depiction of
N-{2-(2H-1,3-benzodioxol-5-yl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl}-3-methylbenzamide
N-{2-(2H-1,3-benzodioxol-5-yl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl}-3-methylbenzamide
Compound characteristics
| Compound ID: | G856-4251 |
| Compound Name: | N-{2-(2H-1,3-benzodioxol-5-yl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl}-3-methylbenzamide |
| Molecular Weight: | 473.57 |
| Molecular Formula: | C28 H31 N3 O4 |
| Smiles: | Cc1cccc(c1)C(NCC(c1ccc2c(c1)OCO2)N1CCN(CC1)c1ccc(cc1)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5915 |
| logD: | 4.5639 |
| logSw: | -4.4106 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.561 |
| InChI Key: | LUOYRCHYBIJCBH-VWLOTQADSA-N |