ethyl 2-{[(1-benzyl-3-phenyl-1H-pyrazol-5-yl)amino]methylidene}-3-oxobutanoate
Chemical Structure Depiction of
ethyl 2-{[(1-benzyl-3-phenyl-1H-pyrazol-5-yl)amino]methylidene}-3-oxobutanoate
ethyl 2-{[(1-benzyl-3-phenyl-1H-pyrazol-5-yl)amino]methylidene}-3-oxobutanoate
Compound characteristics
| Compound ID: | 8008-4268 |
| Compound Name: | ethyl 2-{[(1-benzyl-3-phenyl-1H-pyrazol-5-yl)amino]methylidene}-3-oxobutanoate |
| Molecular Weight: | 389.45 |
| Molecular Formula: | C23 H23 N3 O3 |
| Smiles: | CCOC(C(=C/Nc1cc(c2ccccc2)nn1Cc1ccccc1)\C(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9595 |
| logD: | 3.9535 |
| logSw: | -3.9984 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.447 |
| InChI Key: | FFDWZHIFZFSQGV-UHFFFAOYSA-N |