N-{4-chloro-1-[(3,4-dichlorophenyl)methyl]-1H-pyrazol-3-yl}-N'-(3-nitrophenyl)urea
Chemical Structure Depiction of
N-{4-chloro-1-[(3,4-dichlorophenyl)methyl]-1H-pyrazol-3-yl}-N'-(3-nitrophenyl)urea
N-{4-chloro-1-[(3,4-dichlorophenyl)methyl]-1H-pyrazol-3-yl}-N'-(3-nitrophenyl)urea
Compound characteristics
| Compound ID: | Y205-1543 |
| Compound Name: | N-{4-chloro-1-[(3,4-dichlorophenyl)methyl]-1H-pyrazol-3-yl}-N'-(3-nitrophenyl)urea |
| Molecular Weight: | 440.67 |
| Molecular Formula: | C17 H12 Cl3 N5 O3 |
| Smiles: | C(c1ccc(c(c1)[Cl])[Cl])n1cc(c(NC(Nc2cccc(c2)[N+]([O-])=O)=O)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.4705 |
| logD: | 5.4592 |
| logSw: | -6.0819 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.844 |
| InChI Key: | FEAIIPNAHKVTTK-UHFFFAOYSA-N |