N-[4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)phenyl]-N-[(4-methylphenyl)methyl]cyclopropanecarboxamide
Chemical Structure Depiction of
N-[4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)phenyl]-N-[(4-methylphenyl)methyl]cyclopropanecarboxamide
N-[4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)phenyl]-N-[(4-methylphenyl)methyl]cyclopropanecarboxamide
Compound characteristics
| Compound ID: | V017-1081 |
| Compound Name: | N-[4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)phenyl]-N-[(4-methylphenyl)methyl]cyclopropanecarboxamide |
| Molecular Weight: | 456.54 |
| Molecular Formula: | C28 H28 N2 O4 |
| Smiles: | Cc1ccc(CN(C(C2CC2)=O)c2ccc(CC(NCc3ccc4c(c3)OCO4)=O)cc2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.7086 |
| logD: | 4.7086 |
| logSw: | -4.4533 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.428 |
| InChI Key: | JWIZJCDPLCJSJJ-UHFFFAOYSA-N |