3'-benzyl-5'-(3-chlorophenyl)-1-(2-methylprop-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
3'-benzyl-5'-(3-chlorophenyl)-1-(2-methylprop-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
3'-benzyl-5'-(3-chlorophenyl)-1-(2-methylprop-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: | 8015-9142 |
| Compound Name: | 3'-benzyl-5'-(3-chlorophenyl)-1-(2-methylprop-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: | 512.01 |
| Molecular Formula: | C30 H26 Cl N3 O3 |
| Smiles: | CC(=C)CN1C(C2(C3C(C(Cc4ccccc4)N2)C(N(C3=O)c2cccc(c2)[Cl])=O)c2ccccc12)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.803 |
| logD: | 4.8023 |
| logSw: | -4.8339 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.004 |
| InChI Key: | HTPUQDFPACVWLH-UHFFFAOYSA-N |