2-[2-(3-tert-butyl-5,9-dimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)acetamido]butanoic acid
Chemical Structure Depiction of
2-[2-(3-tert-butyl-5,9-dimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)acetamido]butanoic acid
2-[2-(3-tert-butyl-5,9-dimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)acetamido]butanoic acid
Compound characteristics
| Compound ID: | Y040-4412 |
| Compound Name: | 2-[2-(3-tert-butyl-5,9-dimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)acetamido]butanoic acid |
| Molecular Weight: | 413.47 |
| Molecular Formula: | C23 H27 N O6 |
| Smiles: | CCC(C(O)=O)NC(CC1=C(C)c2cc3c(coc3c(C)c2OC1=O)C(C)(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0282 |
| logD: | -0.5897 |
| logSw: | -3.2514 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.147 |
| InChI Key: | MTLAOAVYJNFNGA-KRWDZBQOSA-N |