2-(4-{[3-(morpholin-4-yl)propyl]amino}-3-nitrophenyl)hexahydro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(4-{[3-(morpholin-4-yl)propyl]amino}-3-nitrophenyl)hexahydro-1H-isoindole-1,3(2H)-dione
2-(4-{[3-(morpholin-4-yl)propyl]amino}-3-nitrophenyl)hexahydro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | K807-0260 |
| Compound Name: | 2-(4-{[3-(morpholin-4-yl)propyl]amino}-3-nitrophenyl)hexahydro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 416.48 |
| Molecular Formula: | C21 H28 N4 O5 |
| Smiles: | C1CCC2C(C1)C(N(C2=O)c1ccc(c(c1)[N+]([O-])=O)NCCCN1CCOCC1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.709 |
| logD: | 1.5829 |
| logSw: | -2.4877 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.422 |
| InChI Key: | NOKMAPIEJXEQGM-UHFFFAOYSA-N |