3-[3-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)prop-2-enoyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[3-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)prop-2-enoyl]-2H-1-benzopyran-2-one
3-[3-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)prop-2-enoyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y505-7200 |
| Compound Name: | 3-[3-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)prop-2-enoyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 322.36 |
| Molecular Formula: | C19 H18 N2 O3 |
| Smiles: | CCn1c(C)c(/C=C/C(C2=Cc3ccccc3OC2=O)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.3768 |
| logD: | 2.3768 |
| logSw: | -2.688 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.414 |
| InChI Key: | MRCXBXTZEWINIS-UHFFFAOYSA-N |