6-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
Chemical Structure Depiction of
6-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
6-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
Compound characteristics
| Compound ID: | Y204-7404 |
| Compound Name: | 6-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}-3,4-dimethylcyclohex-3-ene-1-carboxylic acid |
| Molecular Weight: | 361.44 |
| Molecular Formula: | C20 H27 N O5 |
| Smiles: | CC1CC(C(CC=1C)C(NCCc1ccc(c(c1)OC)OC)=O)C(O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.6597 |
| logD: | -0.6962 |
| logSw: | -2.3744 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.354 |
| InChI Key: | UYOJBKFIFVXBNI-UHFFFAOYSA-N |