N-{1-[(3,4-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-{1-[(3,4-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide
N-{1-[(3,4-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | C226-3182 |
| Compound Name: | N-{1-[(3,4-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 421.32 |
| Molecular Formula: | C20 H22 Cl2 N4 O2 |
| Smiles: | CC(C)Cc1cc(C(Nc2c(C)nn(Cc3ccc(c(c3)[Cl])[Cl])c2C)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.535 |
| logD: | 4.5348 |
| logSw: | -4.465 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.193 |
| InChI Key: | XBXPQKCYCQFVCK-UHFFFAOYSA-N |