5-(2H-1,3-benzodioxol-5-yl)-N-{1-[(3,4-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
5-(2H-1,3-benzodioxol-5-yl)-N-{1-[(3,4-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-1,2-oxazole-3-carboxamide
5-(2H-1,3-benzodioxol-5-yl)-N-{1-[(3,4-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | C226-1244 |
| Compound Name: | 5-(2H-1,3-benzodioxol-5-yl)-N-{1-[(3,4-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 485.33 |
| Molecular Formula: | C23 H18 Cl2 N4 O4 |
| Smiles: | Cc1c(c(C)n(Cc2ccc(c(c2)[Cl])[Cl])n1)NC(c1cc(c2ccc3c(c2)OCO3)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4658 |
| logD: | 4.4657 |
| logSw: | -4.5824 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.867 |
| InChI Key: | NNHLMYHULOANBF-UHFFFAOYSA-N |