8-(3-methoxypropyl)-10-(3-nitrobenzoyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Chemical Structure Depiction of
8-(3-methoxypropyl)-10-(3-nitrobenzoyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
8-(3-methoxypropyl)-10-(3-nitrobenzoyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Compound characteristics
| Compound ID: | IB03-6217 |
| Compound Name: | 8-(3-methoxypropyl)-10-(3-nitrobenzoyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione |
| Molecular Weight: | 461.47 |
| Molecular Formula: | C25 H23 N3 O6 |
| Smiles: | COCCCN1C(C2C(C(C(c3cccc(c3)[N+]([O-])=O)=O)N3C2C=Cc2ccccc23)C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.57 |
| logD: | 2.57 |
| logSw: | -3.37 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 187.02 |
| InChI Key: | JKWZQGHMTWIUEM-UHFFFAOYSA-N |