N-[2-(4-tert-butylphenyl)-4-oxo-4H-1-benzopyran-6-yl]acetamide
Chemical Structure Depiction of
N-[2-(4-tert-butylphenyl)-4-oxo-4H-1-benzopyran-6-yl]acetamide
N-[2-(4-tert-butylphenyl)-4-oxo-4H-1-benzopyran-6-yl]acetamide
Compound characteristics
| Compound ID: | F264-0021 |
| Compound Name: | N-[2-(4-tert-butylphenyl)-4-oxo-4H-1-benzopyran-6-yl]acetamide |
| Molecular Weight: | 335.4 |
| Molecular Formula: | C21 H21 N O3 |
| Smiles: | CC(Nc1ccc2c(c1)C(C=C(c1ccc(cc1)C(C)(C)C)O2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2742 |
| logD: | 5.2741 |
| logSw: | -5.2608 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.047 |
| InChI Key: | DQSIWRSLPXOYIR-UHFFFAOYSA-N |