3-[2-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-2-oxoethyl]-2-benzofuran-1(3H)-one
Chemical Structure Depiction of
3-[2-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-2-oxoethyl]-2-benzofuran-1(3H)-one
3-[2-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-2-oxoethyl]-2-benzofuran-1(3H)-one
Compound characteristics
| Compound ID: | Y505-3226 |
| Compound Name: | 3-[2-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-2-oxoethyl]-2-benzofuran-1(3H)-one |
| Molecular Weight: | 284.31 |
| Molecular Formula: | C16 H16 N2 O3 |
| Smiles: | CCn1cc(C(CC2c3ccccc3C(=O)O2)=O)c(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3447 |
| logD: | 1.3447 |
| logSw: | -2.0717 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.117 |
| InChI Key: | LQPKUHTYTNBETN-OAHLLOKOSA-N |