2-{[(1-ethyl-1H-pyrazol-3-yl)methyl]carbamoyl}cyclohexane-1-carboxylic acid
Chemical Structure Depiction of
2-{[(1-ethyl-1H-pyrazol-3-yl)methyl]carbamoyl}cyclohexane-1-carboxylic acid
2-{[(1-ethyl-1H-pyrazol-3-yl)methyl]carbamoyl}cyclohexane-1-carboxylic acid
Compound characteristics
Compound ID: | Y503-3386 |
Compound Name: | 2-{[(1-ethyl-1H-pyrazol-3-yl)methyl]carbamoyl}cyclohexane-1-carboxylic acid |
Molecular Weight: | 279.34 |
Molecular Formula: | C14 H21 N3 O3 |
Smiles: | CCn1ccc(CNC(C2CCCCC2C(O)=O)=O)n1 |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 0.4601 |
logD: | -2.1906 |
logSw: | -1.9477 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 68.132 |
InChI Key: | UOBISUMVBGGTCD-UHFFFAOYSA-N |