N-[2-(4-tert-butylphenyl)-4-oxo-4H-1-benzopyran-6-yl]-4-fluorobenzamide
Chemical Structure Depiction of
N-[2-(4-tert-butylphenyl)-4-oxo-4H-1-benzopyran-6-yl]-4-fluorobenzamide
N-[2-(4-tert-butylphenyl)-4-oxo-4H-1-benzopyran-6-yl]-4-fluorobenzamide
Compound characteristics
| Compound ID: | F264-0226 |
| Compound Name: | N-[2-(4-tert-butylphenyl)-4-oxo-4H-1-benzopyran-6-yl]-4-fluorobenzamide |
| Molecular Weight: | 415.46 |
| Molecular Formula: | C26 H22 F N O3 |
| Smiles: | CC(C)(C)c1ccc(cc1)C1=CC(c2cc(ccc2O1)NC(c1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.9331 |
| logD: | 6.8995 |
| logSw: | -5.758 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.876 |
| InChI Key: | PRWPHRKQHDENHS-UHFFFAOYSA-N |