3,5-dinitro-N-[2,2,2-trichloro-1-(2-methylanilino)ethyl]benzamide
Chemical Structure Depiction of
3,5-dinitro-N-[2,2,2-trichloro-1-(2-methylanilino)ethyl]benzamide
3,5-dinitro-N-[2,2,2-trichloro-1-(2-methylanilino)ethyl]benzamide
Compound characteristics
| Compound ID: | 1501-0493 |
| Compound Name: | 3,5-dinitro-N-[2,2,2-trichloro-1-(2-methylanilino)ethyl]benzamide |
| Molecular Weight: | 447.66 |
| Molecular Formula: | C16 H13 Cl3 N4 O5 |
| Smiles: | Cc1ccccc1NC(C([Cl])([Cl])[Cl])NC(c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0927 |
| logD: | 1.9502 |
| logSw: | -4.4734 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.515 |
| InChI Key: | FPMMXCSCQRIUHN-OAHLLOKOSA-N |