(3-tert-butyl-4,9-dimethyl-7-oxo-7H-furo[2,3-f][1]benzopyran-8-yl)acetic acid
Chemical Structure Depiction of
(3-tert-butyl-4,9-dimethyl-7-oxo-7H-furo[2,3-f][1]benzopyran-8-yl)acetic acid
(3-tert-butyl-4,9-dimethyl-7-oxo-7H-furo[2,3-f][1]benzopyran-8-yl)acetic acid
Compound characteristics
| Compound ID: | D129-0123 |
| Compound Name: | (3-tert-butyl-4,9-dimethyl-7-oxo-7H-furo[2,3-f][1]benzopyran-8-yl)acetic acid |
| Molecular Weight: | 328.36 |
| Molecular Formula: | C19 H20 O5 |
| Smiles: | CC1=C(CC(O)=O)C(=O)Oc2cc(C)c3c(coc3c12)C(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 3.7172 |
| logD: | 0.2585 |
| logSw: | -4.2263 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.337 |
| InChI Key: | DYVXSJJMPFUJLE-UHFFFAOYSA-N |