N-[4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)phenyl]-N-[(3-fluorophenyl)methyl]-3-phenylprop-2-enamide
Chemical Structure Depiction of
N-[4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)phenyl]-N-[(3-fluorophenyl)methyl]-3-phenylprop-2-enamide
N-[4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)phenyl]-N-[(3-fluorophenyl)methyl]-3-phenylprop-2-enamide
Compound characteristics
| Compound ID: | V016-8334 |
| Compound Name: | N-[4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)phenyl]-N-[(3-fluorophenyl)methyl]-3-phenylprop-2-enamide |
| Molecular Weight: | 522.58 |
| Molecular Formula: | C32 H27 F N2 O4 |
| Smiles: | C(C(NCc1ccc2c(c1)OCO2)=O)c1ccc(cc1)N(Cc1cccc(c1)F)C(/C=C/c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6902 |
| logD: | 5.6902 |
| logSw: | -5.8384 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.377 |
| InChI Key: | ZLGBGWJOEOHOJB-UHFFFAOYSA-N |