N-[(4-methylphenyl)methyl]-N-(3-{2-oxo-2-[(2-phenylethyl)amino]ethyl}phenyl)-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-N-(3-{2-oxo-2-[(2-phenylethyl)amino]ethyl}phenyl)-2H-1,3-benzodioxole-5-carboxamide
N-[(4-methylphenyl)methyl]-N-(3-{2-oxo-2-[(2-phenylethyl)amino]ethyl}phenyl)-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V024-1680 |
| Compound Name: | N-[(4-methylphenyl)methyl]-N-(3-{2-oxo-2-[(2-phenylethyl)amino]ethyl}phenyl)-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 506.6 |
| Molecular Formula: | C32 H30 N2 O4 |
| Smiles: | Cc1ccc(CN(C(c2ccc3c(c2)OCO3)=O)c2cccc(CC(NCCc3ccccc3)=O)c2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1758 |
| logD: | 5.1758 |
| logSw: | -5.0388 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.746 |
| InChI Key: | GRWMIAYOIVDKJW-UHFFFAOYSA-N |