3,5-dinitro-N-phenyl-N-[3-(3,5,5-trimethylhexanamido)propyl]benzamide
Chemical Structure Depiction of
3,5-dinitro-N-phenyl-N-[3-(3,5,5-trimethylhexanamido)propyl]benzamide
3,5-dinitro-N-phenyl-N-[3-(3,5,5-trimethylhexanamido)propyl]benzamide
Compound characteristics
| Compound ID: | V001-4932 |
| Compound Name: | 3,5-dinitro-N-phenyl-N-[3-(3,5,5-trimethylhexanamido)propyl]benzamide |
| Molecular Weight: | 484.55 |
| Molecular Formula: | C25 H32 N4 O6 |
| Smiles: | CC(CC(NCCCN(C(c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O)=O)c1ccccc1)=O)CC(C)(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6835 |
| logD: | 4.6835 |
| logSw: | -4.2738 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 106.915 |
| InChI Key: | BQVZKBKVNDKOMP-GOSISDBHSA-N |