3-methyl-1-{3-nitro-4-[(4-phenylbutyl)amino]phenyl}pyrrolidine-2,5-dione
Chemical Structure Depiction of
3-methyl-1-{3-nitro-4-[(4-phenylbutyl)amino]phenyl}pyrrolidine-2,5-dione
3-methyl-1-{3-nitro-4-[(4-phenylbutyl)amino]phenyl}pyrrolidine-2,5-dione
Compound characteristics
| Compound ID: | K807-4338 |
| Compound Name: | 3-methyl-1-{3-nitro-4-[(4-phenylbutyl)amino]phenyl}pyrrolidine-2,5-dione |
| Molecular Weight: | 381.43 |
| Molecular Formula: | C21 H23 N3 O4 |
| Smiles: | CC1CC(N(C1=O)c1ccc(c(c1)[N+]([O-])=O)NCCCCc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5967 |
| logD: | 3.5967 |
| logSw: | -3.9458 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.888 |
| InChI Key: | KBERZUANNGDAKX-OAHLLOKOSA-N |