6-[(1-ethyl-1H-pyrazol-3-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
Chemical Structure Depiction of
6-[(1-ethyl-1H-pyrazol-3-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
6-[(1-ethyl-1H-pyrazol-3-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
Compound characteristics
| Compound ID: | Y504-7918 |
| Compound Name: | 6-[(1-ethyl-1H-pyrazol-3-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid |
| Molecular Weight: | 263.29 |
| Molecular Formula: | C13 H17 N3 O3 |
| Smiles: | CCn1ccc(NC(C2CC=CCC2C(O)=O)=O)n1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.8963 |
| logD: | -1.4595 |
| logSw: | -2.192 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.882 |
| InChI Key: | YXJHDCVLNNXBGJ-UHFFFAOYSA-N |