2-[4-(diethylamino)-3-nitrophenyl]hexahydro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-[4-(diethylamino)-3-nitrophenyl]hexahydro-1H-isoindole-1,3(2H)-dione
2-[4-(diethylamino)-3-nitrophenyl]hexahydro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | K807-0155 |
| Compound Name: | 2-[4-(diethylamino)-3-nitrophenyl]hexahydro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 345.4 |
| Molecular Formula: | C18 H23 N3 O4 |
| Smiles: | CCN(CC)c1ccc(cc1[N+]([O-])=O)N1C(C2CCCCC2C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.4689 |
| logD: | 2.4689 |
| logSw: | -2.9413 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.588 |
| InChI Key: | PABFBAFIRFRWJB-UHFFFAOYSA-N |