3-tert-butyl-5-methyl-6-[3-oxo-3-(pyrrolidin-1-yl)propyl]-7H-furo[3,2-g][1]benzopyran-7-one
Chemical Structure Depiction of
3-tert-butyl-5-methyl-6-[3-oxo-3-(pyrrolidin-1-yl)propyl]-7H-furo[3,2-g][1]benzopyran-7-one
3-tert-butyl-5-methyl-6-[3-oxo-3-(pyrrolidin-1-yl)propyl]-7H-furo[3,2-g][1]benzopyran-7-one
Compound characteristics
| Compound ID: | D146-0126 |
| Compound Name: | 3-tert-butyl-5-methyl-6-[3-oxo-3-(pyrrolidin-1-yl)propyl]-7H-furo[3,2-g][1]benzopyran-7-one |
| Molecular Weight: | 381.47 |
| Molecular Formula: | C23 H27 N O4 |
| Smiles: | CC1=C(CCC(N2CCCC2)=O)C(=O)Oc2cc3c(cc12)c(co3)C(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 4.3105 |
| logD: | 4.3105 |
| logSw: | -4.3006 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.207 |
| InChI Key: | HUFYKRFCKIJISH-UHFFFAOYSA-N |