2-(4-ethylphenyl)-5-(morpholin-4-yl)-6-nitro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(4-ethylphenyl)-5-(morpholin-4-yl)-6-nitro-1H-isoindole-1,3(2H)-dione
2-(4-ethylphenyl)-5-(morpholin-4-yl)-6-nitro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | K906-0400 |
| Compound Name: | 2-(4-ethylphenyl)-5-(morpholin-4-yl)-6-nitro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 381.39 |
| Molecular Formula: | C20 H19 N3 O5 |
| Smiles: | CCc1ccc(cc1)N1C(c2cc(c(cc2C1=O)N1CCOCC1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4125 |
| logD: | 3.4125 |
| logSw: | -3.7827 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.021 |
| InChI Key: | PFZJWNFIIBSKIK-UHFFFAOYSA-N |