1-benzyl-5'-(3-chlorophenyl)-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
1-benzyl-5'-(3-chlorophenyl)-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
1-benzyl-5'-(3-chlorophenyl)-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: | 8015-3072 |
Compound Name: | 1-benzyl-5'-(3-chlorophenyl)-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: | 532.06 |
Molecular Formula: | C29 H26 Cl N3 O3 S |
Smiles: | CSCCC1C2C(C(N(C2=O)c2cccc(c2)[Cl])=O)C2(C(N(Cc3ccccc3)c3ccccc23)=O)N1 |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 4.3414 |
logD: | 4.3411 |
logSw: | -4.6353 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.004 |
InChI Key: | DZHLJYMOQCOYLT-UHFFFAOYSA-N |