4-hydroxy-6-methyl-3-(1H-pyrazol-3-yl)-2H-pyran-2-one
Chemical Structure Depiction of
4-hydroxy-6-methyl-3-(1H-pyrazol-3-yl)-2H-pyran-2-one
4-hydroxy-6-methyl-3-(1H-pyrazol-3-yl)-2H-pyran-2-one
Compound characteristics
| Compound ID: | Y501-6220 |
| Compound Name: | 4-hydroxy-6-methyl-3-(1H-pyrazol-3-yl)-2H-pyran-2-one |
| Molecular Weight: | 192.17 |
| Molecular Formula: | C9 H8 N2 O3 |
| Smiles: | CC1=CC(=C(C(=O)O1)c1cc[nH]n1)O |
| Stereo: | ACHIRAL |
| logP: | 0.5244 |
| logD: | -4.8586 |
| logSw: | -1.7745 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.472 |
| InChI Key: | PTFCNBWCZAMULF-UHFFFAOYSA-N |