N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}-5-(3,4-dimethoxyphenyl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}-5-(3,4-dimethoxyphenyl)-1,2-oxazole-3-carboxamide
N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}-5-(3,4-dimethoxyphenyl)-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | C226-1131 |
| Compound Name: | N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}-5-(3,4-dimethoxyphenyl)-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 473.31 |
| Molecular Formula: | C22 H18 Cl2 N4 O4 |
| Smiles: | COc1ccc(cc1OC)c1cc(C(Nc2cnn(Cc3ccc(cc3[Cl])[Cl])c2)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.5018 |
| logD: | 4.5016 |
| logSw: | -4.569 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.631 |
| InChI Key: | VMHNGCUXOXMKKJ-UHFFFAOYSA-N |