3-{5,9-dimethyl-7-oxo-3-[4-(pyrrolidin-1-yl)phenyl]-7H-furo[3,2-g][1]benzopyran-6-yl}propanoic acid
Chemical Structure Depiction of
3-{5,9-dimethyl-7-oxo-3-[4-(pyrrolidin-1-yl)phenyl]-7H-furo[3,2-g][1]benzopyran-6-yl}propanoic acid
3-{5,9-dimethyl-7-oxo-3-[4-(pyrrolidin-1-yl)phenyl]-7H-furo[3,2-g][1]benzopyran-6-yl}propanoic acid
Compound characteristics
| Compound ID: | D143-0304 |
| Compound Name: | 3-{5,9-dimethyl-7-oxo-3-[4-(pyrrolidin-1-yl)phenyl]-7H-furo[3,2-g][1]benzopyran-6-yl}propanoic acid |
| Molecular Weight: | 431.49 |
| Molecular Formula: | C26 H25 N O5 |
| Smiles: | CC1=C(CCC(O)=O)C(=O)Oc2c1cc1c(coc1c2C)c1ccc(cc1)N1CCCC1 |
| Stereo: | ACHIRAL |
| logP: | 5.1691 |
| logD: | 2.6729 |
| logSw: | -4.9693 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.568 |
| InChI Key: | UJWPJLRAIOHUQA-UHFFFAOYSA-N |