5'-benzyl-1-(3-chloropropyl)-3'-[2-(methylsulfanyl)ethyl]-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
5'-benzyl-1-(3-chloropropyl)-3'-[2-(methylsulfanyl)ethyl]-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
5'-benzyl-1-(3-chloropropyl)-3'-[2-(methylsulfanyl)ethyl]-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: | 8016-6620 |
| Compound Name: | 5'-benzyl-1-(3-chloropropyl)-3'-[2-(methylsulfanyl)ethyl]-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: | 498.04 |
| Molecular Formula: | C26 H28 Cl N3 O3 S |
| Smiles: | CSCCC1C2C(C(N(Cc3ccccc3)C2=O)=O)C2(C(N(CCC[Cl])c3ccccc23)=O)N1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5462 |
| logD: | 3.4845 |
| logSw: | -3.9793 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.865 |
| InChI Key: | HQFUHOXYYXAZDG-UHFFFAOYSA-N |