4-tert-butyl-N-{4-oxo-2-[4-(propan-2-yl)phenyl]-4H-1-benzopyran-6-yl}benzamide
Chemical Structure Depiction of
4-tert-butyl-N-{4-oxo-2-[4-(propan-2-yl)phenyl]-4H-1-benzopyran-6-yl}benzamide
4-tert-butyl-N-{4-oxo-2-[4-(propan-2-yl)phenyl]-4H-1-benzopyran-6-yl}benzamide
Compound characteristics
| Compound ID: | F264-0298 |
| Compound Name: | 4-tert-butyl-N-{4-oxo-2-[4-(propan-2-yl)phenyl]-4H-1-benzopyran-6-yl}benzamide |
| Molecular Weight: | 439.55 |
| Molecular Formula: | C29 H29 N O3 |
| Smiles: | CC(C)c1ccc(cc1)C1=CC(c2cc(ccc2O1)NC(c1ccc(cc1)C(C)(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 8.2422 |
| logD: | 8.2372 |
| logSw: | -5.7715 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.876 |
| InChI Key: | GBKJRNBLKWGHPM-UHFFFAOYSA-N |