3,5-dimethyl-6-[3-oxo-3-(thiomorpholin-4-yl)propyl]-7H-furo[3,2-g][1]benzopyran-7-one
Chemical Structure Depiction of
3,5-dimethyl-6-[3-oxo-3-(thiomorpholin-4-yl)propyl]-7H-furo[3,2-g][1]benzopyran-7-one
3,5-dimethyl-6-[3-oxo-3-(thiomorpholin-4-yl)propyl]-7H-furo[3,2-g][1]benzopyran-7-one
Compound characteristics
| Compound ID: | Y041-0581 |
| Compound Name: | 3,5-dimethyl-6-[3-oxo-3-(thiomorpholin-4-yl)propyl]-7H-furo[3,2-g][1]benzopyran-7-one |
| Molecular Weight: | 371.45 |
| Molecular Formula: | C20 H21 N O4 S |
| Smiles: | CC1=C(CCC(N2CCSCC2)=O)C(=O)Oc2cc3c(cc12)c(C)co3 |
| Stereo: | ACHIRAL |
| logP: | 2.8889 |
| logD: | 2.8889 |
| logSw: | -3.201 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.841 |
| InChI Key: | ZHKYHDCJGMORGE-UHFFFAOYSA-N |