6-{[(4-fluorophenyl)methyl]carbamoyl}-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
Chemical Structure Depiction of
6-{[(4-fluorophenyl)methyl]carbamoyl}-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
6-{[(4-fluorophenyl)methyl]carbamoyl}-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
Compound characteristics
| Compound ID: | Y204-7411 |
| Compound Name: | 6-{[(4-fluorophenyl)methyl]carbamoyl}-3,4-dimethylcyclohex-3-ene-1-carboxylic acid |
| Molecular Weight: | 305.35 |
| Molecular Formula: | C17 H20 F N O3 |
| Smiles: | CC1CC(C(CC=1C)C(NCc1ccc(cc1)F)=O)C(O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.9981 |
| logD: | -0.3577 |
| logSw: | -2.6812 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.252 |
| InChI Key: | GRHXDXVATYSXBW-UHFFFAOYSA-N |