N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(1-benzylpiperidin-4-yl)-N'-(3-chloro-4-fluorophenyl)urea
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(1-benzylpiperidin-4-yl)-N'-(3-chloro-4-fluorophenyl)urea
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(1-benzylpiperidin-4-yl)-N'-(3-chloro-4-fluorophenyl)urea
Compound characteristics
| Compound ID: | E641-1280 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(1-benzylpiperidin-4-yl)-N'-(3-chloro-4-fluorophenyl)urea |
| Molecular Weight: | 495.98 |
| Molecular Formula: | C27 H27 Cl F N3 O3 |
| Smiles: | C1CN(CCC1N(Cc1ccc2c(c1)OCO2)C(Nc1ccc(c(c1)[Cl])F)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.6725 |
| logD: | 4.8253 |
| logSw: | -6.0327 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.899 |
| InChI Key: | DRBDJLWOHOJJAZ-UHFFFAOYSA-N |