7-[(4-tert-butylphenyl)methoxy]-6-chloro-4-phenyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-[(4-tert-butylphenyl)methoxy]-6-chloro-4-phenyl-2H-1-benzopyran-2-one
7-[(4-tert-butylphenyl)methoxy]-6-chloro-4-phenyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-7180 |
| Compound Name: | 7-[(4-tert-butylphenyl)methoxy]-6-chloro-4-phenyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 418.92 |
| Molecular Formula: | C26 H23 Cl O3 |
| Smiles: | CC(C)(C)c1ccc(COc2cc3c(cc2[Cl])C(=CC(=O)O3)c2ccccc2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 7.2881 |
| logD: | 7.2881 |
| logSw: | -6.2785 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.6884 |
| InChI Key: | DLTMKHKENBOMOP-UHFFFAOYSA-N |