N-[3-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)phenyl]-2-methoxy-N-[(4-methylphenyl)methyl]acetamide
Chemical Structure Depiction of
N-[3-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)phenyl]-2-methoxy-N-[(4-methylphenyl)methyl]acetamide
N-[3-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)phenyl]-2-methoxy-N-[(4-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | V018-4261 |
| Compound Name: | N-[3-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)phenyl]-2-methoxy-N-[(4-methylphenyl)methyl]acetamide |
| Molecular Weight: | 460.53 |
| Molecular Formula: | C27 H28 N2 O5 |
| Smiles: | Cc1ccc(CN(C(COC)=O)c2cccc(CC(NCc3ccc4c(c3)OCO4)=O)c2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7208 |
| logD: | 3.7208 |
| logSw: | -3.9277 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.073 |
| InChI Key: | RTUSIVKYTSCOES-UHFFFAOYSA-N |