N-cyclooctyl-1-[(2,4-dimethylphenoxy)methyl]-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-cyclooctyl-1-[(2,4-dimethylphenoxy)methyl]-1H-pyrazole-3-carboxamide
N-cyclooctyl-1-[(2,4-dimethylphenoxy)methyl]-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y502-2581 |
| Compound Name: | N-cyclooctyl-1-[(2,4-dimethylphenoxy)methyl]-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 355.48 |
| Molecular Formula: | C21 H29 N3 O2 |
| Smiles: | Cc1ccc(c(C)c1)OCn1ccc(C(NC2CCCCCCC2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.3748 |
| logD: | 5.3748 |
| logSw: | -5.2202 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.158 |
| InChI Key: | ZRWOMFYLNKATPA-UHFFFAOYSA-N |