2-(4-{[1-(2-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-ethoxyphenoxy)-N-(2-phenylethyl)acetamide
Chemical Structure Depiction of
2-(4-{[1-(2-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-ethoxyphenoxy)-N-(2-phenylethyl)acetamide
2-(4-{[1-(2-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-ethoxyphenoxy)-N-(2-phenylethyl)acetamide
Compound characteristics
| Compound ID: | Y500-5347 |
| Compound Name: | 2-(4-{[1-(2-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-ethoxyphenoxy)-N-(2-phenylethyl)acetamide |
| Molecular Weight: | 518.01 |
| Molecular Formula: | C29 H28 Cl N3 O4 |
| Smiles: | CCOc1cc(/C=C2/C(C)=NN(C2=O)c2ccccc2[Cl])ccc1OCC(NCCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0164 |
| logD: | 4.0164 |
| logSw: | -4.5139 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.123 |
| InChI Key: | SDNJTTXNTSXZMP-UHFFFAOYSA-N |