1-[(2-chloro-5-methylphenoxy)methyl]-N-(2-chloro-5-nitrophenyl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1-[(2-chloro-5-methylphenoxy)methyl]-N-(2-chloro-5-nitrophenyl)-1H-pyrazole-3-carboxamide
1-[(2-chloro-5-methylphenoxy)methyl]-N-(2-chloro-5-nitrophenyl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y502-3700 |
| Compound Name: | 1-[(2-chloro-5-methylphenoxy)methyl]-N-(2-chloro-5-nitrophenyl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 421.24 |
| Molecular Formula: | C18 H14 Cl2 N4 O4 |
| Smiles: | Cc1ccc(c(c1)OCn1ccc(C(Nc2cc(ccc2[Cl])[N+]([O-])=O)=O)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.6608 |
| logD: | 4.4131 |
| logSw: | -4.8686 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.463 |
| InChI Key: | ITLMXRFQBXRIFT-UHFFFAOYSA-N |