2-[3-(1-ethyl-3-methyl-1H-pyrazol-4-yl)prop-2-enoyl]-6-methyl-4H-pyran-4-one
Chemical Structure Depiction of
2-[3-(1-ethyl-3-methyl-1H-pyrazol-4-yl)prop-2-enoyl]-6-methyl-4H-pyran-4-one
2-[3-(1-ethyl-3-methyl-1H-pyrazol-4-yl)prop-2-enoyl]-6-methyl-4H-pyran-4-one
Compound characteristics
| Compound ID: | Y501-3112 |
| Compound Name: | 2-[3-(1-ethyl-3-methyl-1H-pyrazol-4-yl)prop-2-enoyl]-6-methyl-4H-pyran-4-one |
| Molecular Weight: | 272.3 |
| Molecular Formula: | C15 H16 N2 O3 |
| Smiles: | CCn1cc(/C=C/C(C2=CC(C=C(C)O2)=O)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.0303 |
| logD: | 1.0303 |
| logSw: | -0.9474 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.793 |
| InChI Key: | NGHCAKIZUJXIQM-UHFFFAOYSA-N |