N,N-dimethyl-N'-[2,2,2-trichloro-1-(3-nitroanilino)ethyl]urea
Chemical Structure Depiction of
N,N-dimethyl-N'-[2,2,2-trichloro-1-(3-nitroanilino)ethyl]urea
N,N-dimethyl-N'-[2,2,2-trichloro-1-(3-nitroanilino)ethyl]urea
Compound characteristics
| Compound ID: | 0319-0019 |
| Compound Name: | N,N-dimethyl-N'-[2,2,2-trichloro-1-(3-nitroanilino)ethyl]urea |
| Molecular Weight: | 355.61 |
| Molecular Formula: | C11 H13 Cl3 N4 O3 |
| Smiles: | CN(C)C(NC(C([Cl])([Cl])[Cl])Nc1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7568 |
| logD: | 2.7054 |
| logSw: | -3.5257 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.561 |
| InChI Key: | KLSOBTYDYWNKQL-SECBINFHSA-N |