ethyl 4-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}benzoate
ethyl 4-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}benzoate
Compound characteristics
| Compound ID: | 0517-0055 |
| Compound Name: | ethyl 4-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}benzoate |
| Molecular Weight: | 299.32 |
| Molecular Formula: | C17 H17 N O4 |
| Smiles: | CCOC(c1ccc(cc1)NCc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8138 |
| logD: | 3.8138 |
| logSw: | -3.9589 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.342 |
| InChI Key: | NDVOXAWNJXIRLQ-UHFFFAOYSA-N |