2-(3-methylphenyl)-6-(morpholin-4-yl)-5-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Chemical Structure Depiction of
2-(3-methylphenyl)-6-(morpholin-4-yl)-5-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
2-(3-methylphenyl)-6-(morpholin-4-yl)-5-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Compound characteristics
| Compound ID: | 5386-1111 |
| Compound Name: | 2-(3-methylphenyl)-6-(morpholin-4-yl)-5-nitro-1H-benzo[de]isoquinoline-1,3(2H)-dione |
| Molecular Weight: | 417.42 |
| Molecular Formula: | C23 H19 N3 O5 |
| Smiles: | Cc1cccc(c1)N1C(c2cccc3c(c(cc(C1=O)c23)[N+]([O-])=O)N1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6829 |
| logD: | 3.6829 |
| logSw: | -4.3428 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.082 |
| InChI Key: | BGOVZVSVSDCQGM-UHFFFAOYSA-N |