4-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]thiophene-2-carboxylic acid
Chemical Structure Depiction of
4-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]thiophene-2-carboxylic acid
4-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]thiophene-2-carboxylic acid
Compound characteristics
| Compound ID: | Y504-8782 |
| Compound Name: | 4-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]thiophene-2-carboxylic acid |
| Molecular Weight: | 236.29 |
| Molecular Formula: | C11 H12 N2 O2 S |
| Smiles: | Cc1cc(C)n(Cc2cc(C(O)=O)sc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.0607 |
| logD: | -2.7074 |
| logSw: | -1.6502 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.4 |
| InChI Key: | TWIVYJZTHNAPIY-UHFFFAOYSA-N |