N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(1-benzylpiperidin-4-yl)-N'-(4-methoxyphenyl)urea
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(1-benzylpiperidin-4-yl)-N'-(4-methoxyphenyl)urea
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(1-benzylpiperidin-4-yl)-N'-(4-methoxyphenyl)urea
Compound characteristics
| Compound ID: | E641-1281 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(1-benzylpiperidin-4-yl)-N'-(4-methoxyphenyl)urea |
| Molecular Weight: | 473.57 |
| Molecular Formula: | C28 H31 N3 O4 |
| Smiles: | COc1ccc(cc1)NC(N(Cc1ccc2c(c1)OCO2)C1CCN(CC1)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9248 |
| logD: | 4.0776 |
| logSw: | -4.6148 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.443 |
| InChI Key: | XBCOFNPPTJSCOK-UHFFFAOYSA-N |