6-tert-butyl-4-(5-chloro-3-methyl-1-benzofuran-2-yl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-tert-butyl-4-(5-chloro-3-methyl-1-benzofuran-2-yl)-2H-1-benzopyran-2-one
6-tert-butyl-4-(5-chloro-3-methyl-1-benzofuran-2-yl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-1119 |
| Compound Name: | 6-tert-butyl-4-(5-chloro-3-methyl-1-benzofuran-2-yl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 366.84 |
| Molecular Formula: | C22 H19 Cl O3 |
| Smiles: | Cc1c2cc(ccc2oc1C1=CC(=O)Oc2ccc(cc12)C(C)(C)C)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.5492 |
| logD: | 6.5492 |
| logSw: | -6.279 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.9 |
| InChI Key: | XRINDDIFFQPGBZ-UHFFFAOYSA-N |