7-[2-(morpholin-4-yl)-2-oxoethyl]-10-(pyridin-3-yl)-3,4a,5,5a,8a,9,9a,10-octahydro-5,9-methano[1,3]thiazolo[5',4':5,6]thiopyrano[2,3-f]isoindole-2,6,8(7H)-trione
Chemical Structure Depiction of
7-[2-(morpholin-4-yl)-2-oxoethyl]-10-(pyridin-3-yl)-3,4a,5,5a,8a,9,9a,10-octahydro-5,9-methano[1,3]thiazolo[5',4':5,6]thiopyrano[2,3-f]isoindole-2,6,8(7H)-trione
7-[2-(morpholin-4-yl)-2-oxoethyl]-10-(pyridin-3-yl)-3,4a,5,5a,8a,9,9a,10-octahydro-5,9-methano[1,3]thiazolo[5',4':5,6]thiopyrano[2,3-f]isoindole-2,6,8(7H)-trione
Compound characteristics
| Compound ID: | G857-2172 |
| Compound Name: | 7-[2-(morpholin-4-yl)-2-oxoethyl]-10-(pyridin-3-yl)-3,4a,5,5a,8a,9,9a,10-octahydro-5,9-methano[1,3]thiazolo[5',4':5,6]thiopyrano[2,3-f]isoindole-2,6,8(7H)-trione |
| Molecular Weight: | 512.61 |
| Molecular Formula: | C24 H24 N4 O5 S2 |
| Smiles: | C1C2C3C(C4=C(NC(=O)S4)SC3C1C1C2C(N(CC(N2CCOCC2)=O)C1=O)=O)c1cccnc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.2501 |
| logD: | 0.2501 |
| logSw: | -1.8275 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.867 |
| InChI Key: | XDIYADHIPATDPF-UHFFFAOYSA-N |