2-[(1-benzyl-1H-pyrazol-4-yl)carbamoyl]cyclohexane-1-carboxylic acid
Chemical Structure Depiction of
2-[(1-benzyl-1H-pyrazol-4-yl)carbamoyl]cyclohexane-1-carboxylic acid
2-[(1-benzyl-1H-pyrazol-4-yl)carbamoyl]cyclohexane-1-carboxylic acid
Compound characteristics
| Compound ID: | Y508-5714 |
| Compound Name: | 2-[(1-benzyl-1H-pyrazol-4-yl)carbamoyl]cyclohexane-1-carboxylic acid |
| Molecular Weight: | 327.38 |
| Molecular Formula: | C18 H21 N3 O3 |
| Smiles: | C1CCC(C(C1)C(O)=O)C(Nc1cnn(Cc2ccccc2)c1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.9357 |
| logD: | -0.715 |
| logSw: | -2.4743 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.436 |
| InChI Key: | FMZQRXKMUFIYCN-UHFFFAOYSA-N |