(10RS)-7-(4-fluorophenyl)-10-(2-hydroxyphenyl)-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
(10RS)-7-(4-fluorophenyl)-10-(2-hydroxyphenyl)-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
(10RS)-7-(4-fluorophenyl)-10-(2-hydroxyphenyl)-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: | D426-0840 |
| Compound Name: | (10RS)-7-(4-fluorophenyl)-10-(2-hydroxyphenyl)-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: | 494.56 |
| Molecular Formula: | C25 H19 F N2 O4 S2 |
| Smiles: | [H][C@]1(C2C3CC(C4C3C(N(C4=O)c3ccc(cc3)F)=O)C2SC2=C1SC(N2)=O)c1ccccc1O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.6053 |
| logD: | 3.6048 |
| logSw: | -3.452 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.984 |
| InChI Key: | BBNFSWHWBFQHPY-SLQJSBHFSA-N |