3-methyl-N-[2,2,2-trichloro-1-(3-nitroanilino)ethyl]benzamide
Chemical Structure Depiction of
3-methyl-N-[2,2,2-trichloro-1-(3-nitroanilino)ethyl]benzamide
3-methyl-N-[2,2,2-trichloro-1-(3-nitroanilino)ethyl]benzamide
Compound characteristics
| Compound ID: | 1491-0162 |
| Compound Name: | 3-methyl-N-[2,2,2-trichloro-1-(3-nitroanilino)ethyl]benzamide |
| Molecular Weight: | 402.66 |
| Molecular Formula: | C16 H14 Cl3 N3 O3 |
| Smiles: | Cc1cccc(c1)C(NC(C([Cl])([Cl])[Cl])Nc1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5091 |
| logD: | 2.9395 |
| logSw: | -4.755 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.831 |
| InChI Key: | MRPXKFUBGGRXCC-OAHLLOKOSA-N |