N~1~,N~1~-diethyl-N~3~-[(4-nitrophenyl)methyl]propane-1,3-diamine--oxalic acid (1/1)
Chemical Structure Depiction of
N~1~,N~1~-diethyl-N~3~-[(4-nitrophenyl)methyl]propane-1,3-diamine--oxalic acid (1/1)
N~1~,N~1~-diethyl-N~3~-[(4-nitrophenyl)methyl]propane-1,3-diamine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | K786-4762 |
| Compound Name: | N~1~,N~1~-diethyl-N~3~-[(4-nitrophenyl)methyl]propane-1,3-diamine--oxalic acid (1/1) |
| Molecular Weight: | 355.39 |
| Molecular Formula: | C14 H23 N3 O2 |
| Salt: | HOOCCOOH |
| Smiles: | CCN(CC)CCCNCc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.9622 |
| logD: | -0.2623 |
| logSw: | -2.3276 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.91 |
| InChI Key: | KUSUGDZWVLICCN-UHFFFAOYSA-N |