5'-benzyl-3'-(2-methylpropyl)-1-(prop-2-en-1-yl)-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-3'-(2-methylpropyl)-1-(prop-2-en-1-yl)-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-3'-(2-methylpropyl)-1-(prop-2-en-1-yl)-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: | 8013-0116 |
| Compound Name: | 5'-benzyl-3'-(2-methylpropyl)-1-(prop-2-en-1-yl)-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: | 443.55 |
| Molecular Formula: | C27 H29 N3 O3 |
| Smiles: | CC(C)CC1C2C(C(N(Cc3ccccc3)C2=O)=O)C2(C(N(CC=C)c3ccccc23)=O)N1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.7622 |
| logD: | 3.7596 |
| logSw: | -4.1533 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.865 |
| InChI Key: | AAPFVZOGMOQGDV-UHFFFAOYSA-N |