N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-tert-butylphenyl)quinoline-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-tert-butylphenyl)quinoline-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-tert-butylphenyl)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | 3360-9970 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-tert-butylphenyl)quinoline-4-carboxamide |
| Molecular Weight: | 438.53 |
| Molecular Formula: | C28 H26 N2 O3 |
| Smiles: | CC(C)(C)c1ccc(cc1)c1cc(C(NCc2ccc3c(c2)OCO3)=O)c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 7.2267 |
| logD: | 7.2265 |
| logSw: | -5.8327 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.826 |
| InChI Key: | AUTLBQYOZIIOIS-UHFFFAOYSA-N |