2-[(4-methoxyphenyl)methyl]-5-(morpholin-4-yl)-6-nitro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-[(4-methoxyphenyl)methyl]-5-(morpholin-4-yl)-6-nitro-1H-isoindole-1,3(2H)-dione
2-[(4-methoxyphenyl)methyl]-5-(morpholin-4-yl)-6-nitro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | K906-0402 |
| Compound Name: | 2-[(4-methoxyphenyl)methyl]-5-(morpholin-4-yl)-6-nitro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 397.39 |
| Molecular Formula: | C20 H19 N3 O6 |
| Smiles: | COc1ccc(CN2C(c3cc(c(cc3C2=O)N2CCOCC2)[N+]([O-])=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.6731 |
| logD: | 2.6731 |
| logSw: | -3.1268 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 81.176 |
| InChI Key: | FMAJEAQCIQHZCL-UHFFFAOYSA-N |