5-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]furan-2-carboxylic acid
Chemical Structure Depiction of
5-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]furan-2-carboxylic acid
5-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]furan-2-carboxylic acid
Compound characteristics
| Compound ID: | Y510-0976 |
| Compound Name: | 5-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]furan-2-carboxylic acid |
| Molecular Weight: | 220.22 |
| Molecular Formula: | C11 H12 N2 O3 |
| Smiles: | Cc1c(Cc2ccc(C(O)=O)o2)c(C)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 1.5626 |
| logD: | -2.1347 |
| logSw: | -1.8476 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.131 |
| InChI Key: | NPBZTOKSEXKKAG-UHFFFAOYSA-N |