N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-(2,5-dimethylphenyl)-N-(1-ethylpiperidin-4-yl)urea
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-(2,5-dimethylphenyl)-N-(1-ethylpiperidin-4-yl)urea
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-(2,5-dimethylphenyl)-N-(1-ethylpiperidin-4-yl)urea
Compound characteristics
| Compound ID: | E641-1454 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-(2,5-dimethylphenyl)-N-(1-ethylpiperidin-4-yl)urea |
| Molecular Weight: | 409.53 |
| Molecular Formula: | C24 H31 N3 O3 |
| Smiles: | CCN1CCC(CC1)N(Cc1ccc2c(c1)OCO2)C(Nc1cc(C)ccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2261 |
| logD: | 2.2991 |
| logSw: | -4.0058 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.198 |
| InChI Key: | XLXYWZQLRAGEQI-UHFFFAOYSA-N |