N-[3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)phenyl]-N-[(4-methylphenyl)methyl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)phenyl]-N-[(4-methylphenyl)methyl]-2H-1,3-benzodioxole-5-carboxamide
N-[3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)phenyl]-N-[(4-methylphenyl)methyl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V024-1626 |
| Compound Name: | N-[3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)phenyl]-N-[(4-methylphenyl)methyl]-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 510.57 |
| Molecular Formula: | C31 H27 F N2 O4 |
| Smiles: | Cc1ccc(CN(C(c2ccc3c(c2)OCO3)=O)c2cccc(CC(NCc3ccc(cc3)F)=O)c2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.4302 |
| logD: | 5.4302 |
| logSw: | -5.3938 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.905 |
| InChI Key: | XGDPJGNLFPRPHW-UHFFFAOYSA-N |