2-(1-ethyl-1H-pyrazol-5-yl)-3-hydroxy-4H-1-benzopyran-4-one
Chemical Structure Depiction of
2-(1-ethyl-1H-pyrazol-5-yl)-3-hydroxy-4H-1-benzopyran-4-one
2-(1-ethyl-1H-pyrazol-5-yl)-3-hydroxy-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | Y505-7203 |
| Compound Name: | 2-(1-ethyl-1H-pyrazol-5-yl)-3-hydroxy-4H-1-benzopyran-4-one |
| Molecular Weight: | 256.26 |
| Molecular Formula: | C14 H12 N2 O3 |
| Smiles: | CCn1c(ccn1)C1=C(C(c2ccccc2O1)=O)O |
| Stereo: | ACHIRAL |
| logP: | 1.3724 |
| logD: | 0.9172 |
| logSw: | -2.4256 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.438 |
| InChI Key: | IMOQTPCQZGYIKA-UHFFFAOYSA-N |