6,8-di-tert-butyl-3-(4-methoxybenzene-1-sulfonyl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6,8-di-tert-butyl-3-(4-methoxybenzene-1-sulfonyl)-2H-1-benzopyran-2-one
6,8-di-tert-butyl-3-(4-methoxybenzene-1-sulfonyl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | C566-1008 |
| Compound Name: | 6,8-di-tert-butyl-3-(4-methoxybenzene-1-sulfonyl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 428.55 |
| Molecular Formula: | C24 H28 O5 S |
| Smiles: | CC(C)(C)c1cc2C=C(C(=O)Oc2c(c1)C(C)(C)C)S(c1ccc(cc1)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2844 |
| logD: | 6.2844 |
| logSw: | -5.67 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.889 |
| InChI Key: | TWCWQFAUVOTACO-UHFFFAOYSA-N |