methyl 2-{[3-(furan-2-yl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-oxo-2,3-dihydro-1-benzofuran-5-carboxylate
Chemical Structure Depiction of
methyl 2-{[3-(furan-2-yl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-oxo-2,3-dihydro-1-benzofuran-5-carboxylate
methyl 2-{[3-(furan-2-yl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-oxo-2,3-dihydro-1-benzofuran-5-carboxylate
Compound characteristics
| Compound ID: | C711-0440 |
| Compound Name: | methyl 2-{[3-(furan-2-yl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-oxo-2,3-dihydro-1-benzofuran-5-carboxylate |
| Molecular Weight: | 412.4 |
| Molecular Formula: | C24 H16 N2 O5 |
| Smiles: | [H]C(=C1/C(c2cc(ccc2O1)C(=O)OC)=O)\c1cn(c2ccccc2)nc1c1ccco1 |
| Stereo: | ACHIRAL |
| logP: | 4.4359 |
| logD: | 4.4359 |
| logSw: | -4.4679 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.748 |
| InChI Key: | RYCUWZIRHXYKCP-UHFFFAOYSA-N |