5-chloro-7-methyl-2'-(3-nitrophenyl)-3'a,6',7',8',8'a,8'b-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Chemical Structure Depiction of
5-chloro-7-methyl-2'-(3-nitrophenyl)-3'a,6',7',8',8'a,8'b-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
5-chloro-7-methyl-2'-(3-nitrophenyl)-3'a,6',7',8',8'a,8'b-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Compound characteristics
| Compound ID: | IB02-8397 |
| Compound Name: | 5-chloro-7-methyl-2'-(3-nitrophenyl)-3'a,6',7',8',8'a,8'b-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione |
| Molecular Weight: | 466.88 |
| Molecular Formula: | C23 H19 Cl N4 O5 |
| Smiles: | Cc1cc(cc2c1NC(C21C2C(C3CCCN13)C(N(C2=O)c1cccc(c1)[N+]([O-])=O)=O)=O)[Cl] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.41 |
| logD: | 2.38 |
| logSw: | -3.54 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 185.21 |
| InChI Key: | BJZGBHAJOKWAMJ-UHFFFAOYSA-N |