3,5-dinitro-N-[2,2,2-trichloro-1-(2,5-dimethylanilino)ethyl]benzamide
Chemical Structure Depiction of
3,5-dinitro-N-[2,2,2-trichloro-1-(2,5-dimethylanilino)ethyl]benzamide
3,5-dinitro-N-[2,2,2-trichloro-1-(2,5-dimethylanilino)ethyl]benzamide
Compound characteristics
| Compound ID: | 1501-0501 |
| Compound Name: | 3,5-dinitro-N-[2,2,2-trichloro-1-(2,5-dimethylanilino)ethyl]benzamide |
| Molecular Weight: | 461.69 |
| Molecular Formula: | C17 H15 Cl3 N4 O5 |
| Smiles: | Cc1ccc(C)c(c1)NC(C([Cl])([Cl])[Cl])NC(c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.417 |
| logD: | 2.2745 |
| logSw: | -4.6177 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.515 |
| InChI Key: | PHBOKPFUTHCAOP-MRXNPFEDSA-N |