N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-chloro-2-methoxybenzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-chloro-2-methoxybenzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-chloro-2-methoxybenzamide
Compound characteristics
| Compound ID: | Y032-1709 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-chloro-2-methoxybenzamide |
| Molecular Weight: | 319.74 |
| Molecular Formula: | C16 H14 Cl N O4 |
| Smiles: | COc1ccc(cc1C(NCc1ccc2c(c1)OCO2)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.5613 |
| logD: | 3.5612 |
| logSw: | -3.9224 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.398 |
| InChI Key: | RYLFOEMRTJXTKH-UHFFFAOYSA-N |