1-[(3,4-dichlorophenyl)methyl]-3'-[2-(methylsulfanyl)ethyl]-5'-[3-(trifluoromethyl)phenyl]-3'a,6'a-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Chemical Structure Depiction of
1-[(3,4-dichlorophenyl)methyl]-3'-[2-(methylsulfanyl)ethyl]-5'-[3-(trifluoromethyl)phenyl]-3'a,6'a-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
1-[(3,4-dichlorophenyl)methyl]-3'-[2-(methylsulfanyl)ethyl]-5'-[3-(trifluoromethyl)phenyl]-3'a,6'a-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Compound characteristics
| Compound ID: | 8016-8206 |
| Compound Name: | 1-[(3,4-dichlorophenyl)methyl]-3'-[2-(methylsulfanyl)ethyl]-5'-[3-(trifluoromethyl)phenyl]-3'a,6'a-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione |
| Molecular Weight: | 634.5 |
| Molecular Formula: | C30 H24 Cl2 F3 N3 O3 S |
| Smiles: | CSCCC1C2C(C(N(C2=O)c2cccc(c2)C(F)(F)F)=O)C2(C(N(Cc3ccc(c(c3)[Cl])[Cl])c3ccccc23)=O)N1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.8756 |
| logD: | 5.8753 |
| logSw: | -5.98 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.004 |
| InChI Key: | KPXRSOBZIDDLJG-UHFFFAOYSA-N |