N-[3-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)phenyl]-N-benzyl-3-phenylprop-2-enamide
Chemical Structure Depiction of
N-[3-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)phenyl]-N-benzyl-3-phenylprop-2-enamide
N-[3-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)phenyl]-N-benzyl-3-phenylprop-2-enamide
Compound characteristics
| Compound ID: | V017-1846 |
| Compound Name: | N-[3-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)phenyl]-N-benzyl-3-phenylprop-2-enamide |
| Molecular Weight: | 504.59 |
| Molecular Formula: | C32 H28 N2 O4 |
| Smiles: | C(C(NCc1ccc2c(c1)OCO2)=O)c1cccc(c1)N(Cc1ccccc1)C(/C=C/c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.619 |
| logD: | 5.619 |
| logSw: | -5.822 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.377 |
| InChI Key: | MHPKBJDHZFJNAE-UHFFFAOYSA-N |