N-[(4-tert-butylphenyl)methyl]-4-oxo-N-(pyridin-2-yl)-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
N-[(4-tert-butylphenyl)methyl]-4-oxo-N-(pyridin-2-yl)-4H-1-benzopyran-2-carboxamide
N-[(4-tert-butylphenyl)methyl]-4-oxo-N-(pyridin-2-yl)-4H-1-benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | D341-1754 |
| Compound Name: | N-[(4-tert-butylphenyl)methyl]-4-oxo-N-(pyridin-2-yl)-4H-1-benzopyran-2-carboxamide |
| Molecular Weight: | 412.49 |
| Molecular Formula: | C26 H24 N2 O3 |
| Smiles: | CC(C)(C)c1ccc(CN(C(C2=CC(c3ccccc3O2)=O)=O)c2ccccn2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.9935 |
| logD: | 5.9935 |
| logSw: | -5.5308 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.919 |
| InChI Key: | PYQSAGOETQKJCJ-UHFFFAOYSA-N |