2-nitro-N-[2,2,2-trichloro-1-(3-nitroanilino)ethyl]benzamide
Chemical Structure Depiction of
2-nitro-N-[2,2,2-trichloro-1-(3-nitroanilino)ethyl]benzamide
2-nitro-N-[2,2,2-trichloro-1-(3-nitroanilino)ethyl]benzamide
Compound characteristics
Compound ID: | 1491-0201 |
Compound Name: | 2-nitro-N-[2,2,2-trichloro-1-(3-nitroanilino)ethyl]benzamide |
Molecular Weight: | 433.63 |
Molecular Formula: | C15 H11 Cl3 N4 O5 |
Smiles: | c1ccc(c(c1)C(NC(C([Cl])([Cl])[Cl])Nc1cccc(c1)[N+]([O-])=O)=O)[N+]([O-])=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.135 |
logD: | 0.6654 |
logSw: | -4.5694 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 99.912 |
InChI Key: | NMUSALFPZBVOOR-CQSZACIVSA-N |