N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-3-oxopropyl)-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-3-oxopropyl)-3,4,5-trimethoxybenzamide
N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-3-oxopropyl)-3,4,5-trimethoxybenzamide
Compound characteristics
| Compound ID: | K784-8060 |
| Compound Name: | N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-3-oxopropyl)-3,4,5-trimethoxybenzamide |
| Molecular Weight: | 416.43 |
| Molecular Formula: | C21 H24 N2 O7 |
| Smiles: | COc1cc(cc(c1OC)OC)C(NCCC(NCc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4734 |
| logD: | 1.4734 |
| logSw: | -2.2745 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.058 |
| InChI Key: | RYAFCXITHUMHAI-UHFFFAOYSA-N |