3-benzyl-8-(4-chlorophenyl)-6-[3-(trifluoromethyl)phenyl]-3,4a,7a,8-tetrahydropyrrolo[3',4':5,6]thiopyrano[2,3-d][1,3]thiazole-2,5,7(6H)-trione
Chemical Structure Depiction of
3-benzyl-8-(4-chlorophenyl)-6-[3-(trifluoromethyl)phenyl]-3,4a,7a,8-tetrahydropyrrolo[3',4':5,6]thiopyrano[2,3-d][1,3]thiazole-2,5,7(6H)-trione
3-benzyl-8-(4-chlorophenyl)-6-[3-(trifluoromethyl)phenyl]-3,4a,7a,8-tetrahydropyrrolo[3',4':5,6]thiopyrano[2,3-d][1,3]thiazole-2,5,7(6H)-trione
Compound characteristics
| Compound ID: | 6193-0931 |
| Compound Name: | 3-benzyl-8-(4-chlorophenyl)-6-[3-(trifluoromethyl)phenyl]-3,4a,7a,8-tetrahydropyrrolo[3',4':5,6]thiopyrano[2,3-d][1,3]thiazole-2,5,7(6H)-trione |
| Molecular Weight: | 587.04 |
| Molecular Formula: | C28 H18 Cl F3 N2 O3 S2 |
| Smiles: | C(c1ccccc1)N1C2=C(C(C3C(C(N(C3=O)c3cccc(c3)C(F)(F)F)=O)S2)c2ccc(cc2)[Cl])SC1=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.8555 |
| logD: | 6.8555 |
| logSw: | -6.6909 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 44.785 |
| InChI Key: | USUMMUPDVBVJKX-UHFFFAOYSA-N |