3-methyl-1-(3-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
3-methyl-1-(3-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxylic acid
3-methyl-1-(3-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | C799-0611 |
| Compound Name: | 3-methyl-1-(3-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 281.31 |
| Molecular Formula: | C16 H15 N3 O2 |
| Smiles: | Cc1cccc(c1)n1c(c(C(O)=O)c(C)n1)n1cccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1667 |
| logD: | -1.893 |
| logSw: | -2.9264 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.856 |
| InChI Key: | BAVRXIVJQDOLQZ-UHFFFAOYSA-N |