N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{2-[(3-ethoxypropyl)amino]-2-oxo-1-phenylethyl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{2-[(3-ethoxypropyl)amino]-2-oxo-1-phenylethyl}-2H-1,3-benzodioxole-5-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{2-[(3-ethoxypropyl)amino]-2-oxo-1-phenylethyl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | C094-2152 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{2-[(3-ethoxypropyl)amino]-2-oxo-1-phenylethyl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 518.57 |
| Molecular Formula: | C29 H30 N2 O7 |
| Smiles: | CCOCCCNC(C(c1ccccc1)N(Cc1ccc2c(c1)OCO2)C(c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9899 |
| logD: | 3.9899 |
| logSw: | -4.0617 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.897 |
| InChI Key: | LJIHLYQHPMOINT-HHHXNRCGSA-N |