N-{3-[(2H-1,3-benzodioxol-5-yl)amino]-3-oxopropyl}-3-methoxybenzamide
Chemical Structure Depiction of
N-{3-[(2H-1,3-benzodioxol-5-yl)amino]-3-oxopropyl}-3-methoxybenzamide
N-{3-[(2H-1,3-benzodioxol-5-yl)amino]-3-oxopropyl}-3-methoxybenzamide
Compound characteristics
| Compound ID: | Y032-4495 |
| Compound Name: | N-{3-[(2H-1,3-benzodioxol-5-yl)amino]-3-oxopropyl}-3-methoxybenzamide |
| Molecular Weight: | 342.35 |
| Molecular Formula: | C18 H18 N2 O5 |
| Smiles: | COc1cccc(c1)C(NCCC(Nc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9745 |
| logD: | 1.9744 |
| logSw: | -2.6372 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.302 |
| InChI Key: | FIGAGTZLVJHVRO-UHFFFAOYSA-N |