2,3,5,9-tetramethyl-6-[3-oxo-3-(thiomorpholin-4-yl)propyl]-7H-furo[3,2-g][1]benzopyran-7-one
Chemical Structure Depiction of
2,3,5,9-tetramethyl-6-[3-oxo-3-(thiomorpholin-4-yl)propyl]-7H-furo[3,2-g][1]benzopyran-7-one
2,3,5,9-tetramethyl-6-[3-oxo-3-(thiomorpholin-4-yl)propyl]-7H-furo[3,2-g][1]benzopyran-7-one
Compound characteristics
| Compound ID: | Y041-0582 |
| Compound Name: | 2,3,5,9-tetramethyl-6-[3-oxo-3-(thiomorpholin-4-yl)propyl]-7H-furo[3,2-g][1]benzopyran-7-one |
| Molecular Weight: | 399.51 |
| Molecular Formula: | C22 H25 N O4 S |
| Smiles: | CC1=C(CCC(N2CCSCC2)=O)C(=O)Oc2c1cc1c(C)c(C)oc1c2C |
| Stereo: | ACHIRAL |
| logP: | 3.6156 |
| logD: | 3.6156 |
| logSw: | -3.919 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.146 |
| InChI Key: | BDVOHBPOSHOMEI-UHFFFAOYSA-N |