1-methyl-1'-(3-nitrophenyl)-2,5'-dioxo-2'-(1H-pyrrol-1-yl)-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Chemical Structure Depiction of
1-methyl-1'-(3-nitrophenyl)-2,5'-dioxo-2'-(1H-pyrrol-1-yl)-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
1-methyl-1'-(3-nitrophenyl)-2,5'-dioxo-2'-(1H-pyrrol-1-yl)-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Compound characteristics
| Compound ID: | 8017-6921 |
| Compound Name: | 1-methyl-1'-(3-nitrophenyl)-2,5'-dioxo-2'-(1H-pyrrol-1-yl)-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile |
| Molecular Weight: | 491.51 |
| Molecular Formula: | C28 H21 N5 O4 |
| Smiles: | CN1C(C2(C(C#N)=C(N(C3CCCC(C2=3)=O)c2cccc(c2)[N+]([O-])=O)n2cccc2)c2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8266 |
| logD: | 3.8266 |
| logSw: | -4.1127 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 85.441 |
| InChI Key: | CEJNRDKJTPZQJO-MUUNZHRXSA-N |