2-({[(4-methoxyphenyl)methyl]amino}methylidene)-5-phenylcyclohexane-1,3-dione
Chemical Structure Depiction of
2-({[(4-methoxyphenyl)methyl]amino}methylidene)-5-phenylcyclohexane-1,3-dione
2-({[(4-methoxyphenyl)methyl]amino}methylidene)-5-phenylcyclohexane-1,3-dione
Compound characteristics
| Compound ID: | 3533-0179 |
| Compound Name: | 2-({[(4-methoxyphenyl)methyl]amino}methylidene)-5-phenylcyclohexane-1,3-dione |
| Molecular Weight: | 335.4 |
| Molecular Formula: | C21 H21 N O3 |
| Smiles: | COc1ccc(CNC=C2C(CC(CC2=O)c2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.9075 |
| logD: | 2.9072 |
| logSw: | -3.1542 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.059 |
| InChI Key: | CYLLFZFVYWTNCM-UHFFFAOYSA-N |