N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(3-tert-butyl-5,9-dimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)propanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(3-tert-butyl-5,9-dimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)propanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(3-tert-butyl-5,9-dimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)propanamide
Compound characteristics
| Compound ID: | D146-0115 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(3-tert-butyl-5,9-dimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)propanamide |
| Molecular Weight: | 475.54 |
| Molecular Formula: | C28 H29 N O6 |
| Smiles: | CC1=C(CCC(NCc2ccc3c(c2)OCO3)=O)C(=O)Oc2c1cc1c(coc1c2C)C(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 5.197 |
| logD: | 5.197 |
| logSw: | -5.2733 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.952 |
| InChI Key: | XLZSWDQHCTWEKF-UHFFFAOYSA-N |