4-[3-(1-ethyl-3-methyl-1H-pyrazol-4-yl)prop-2-enamido]benzamide
Chemical Structure Depiction of
4-[3-(1-ethyl-3-methyl-1H-pyrazol-4-yl)prop-2-enamido]benzamide
4-[3-(1-ethyl-3-methyl-1H-pyrazol-4-yl)prop-2-enamido]benzamide
Compound characteristics
| Compound ID: | Y501-1081 |
| Compound Name: | 4-[3-(1-ethyl-3-methyl-1H-pyrazol-4-yl)prop-2-enamido]benzamide |
| Molecular Weight: | 298.34 |
| Molecular Formula: | C16 H18 N4 O2 |
| Smiles: | CCn1cc(\C=C/C(Nc2ccc(cc2)C(N)=O)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.0049 |
| logD: | 1.0048 |
| logSw: | -2.0329 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 72.03 |
| InChI Key: | LDCLLNBEOIXCCC-UHFFFAOYSA-N |