N-[2-(4-tert-butylphenyl)-2-(piperidin-1-yl)ethyl]-6-ethyl-4-oxo-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
N-[2-(4-tert-butylphenyl)-2-(piperidin-1-yl)ethyl]-6-ethyl-4-oxo-4H-1-benzopyran-2-carboxamide
N-[2-(4-tert-butylphenyl)-2-(piperidin-1-yl)ethyl]-6-ethyl-4-oxo-4H-1-benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | D491-2832 |
| Compound Name: | N-[2-(4-tert-butylphenyl)-2-(piperidin-1-yl)ethyl]-6-ethyl-4-oxo-4H-1-benzopyran-2-carboxamide |
| Molecular Weight: | 460.62 |
| Molecular Formula: | C29 H36 N2 O3 |
| Smiles: | [H]N(CC(c1ccc(cc1)C(C)(C)C)N1CCCCC1)C(C1=CC(c2cc(CC)ccc2O1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3069 |
| logD: | 5.3518 |
| logSw: | -5.4612 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.459 |
| InChI Key: | LVLVNKOHAQZEAL-DEOSSOPVSA-N |