6-nitro-2-{[(3-nitrophenyl)methylidene]amino}-1H-benzo[de]isoquinoline-1,3(2H)-dione
Chemical Structure Depiction of
6-nitro-2-{[(3-nitrophenyl)methylidene]amino}-1H-benzo[de]isoquinoline-1,3(2H)-dione
6-nitro-2-{[(3-nitrophenyl)methylidene]amino}-1H-benzo[de]isoquinoline-1,3(2H)-dione
Compound characteristics
| Compound ID: | 0645-0170 |
| Compound Name: | 6-nitro-2-{[(3-nitrophenyl)methylidene]amino}-1H-benzo[de]isoquinoline-1,3(2H)-dione |
| Molecular Weight: | 390.31 |
| Molecular Formula: | C19 H10 N4 O6 |
| Smiles: | C(\c1cccc(c1)[N+]([O-])=O)=N/N1C(c2cccc3c(ccc(C1=O)c23)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0291 |
| logD: | 3.0291 |
| logSw: | -3.8602 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 105.731 |
| InChI Key: | ZFMNJFFIMKZFRK-UHFFFAOYSA-N |