6-{[2-(3,4-diethoxyphenyl)ethyl]carbamoyl}-4-methylcyclohex-3-ene-1-carboxylic acid
Chemical Structure Depiction of
6-{[2-(3,4-diethoxyphenyl)ethyl]carbamoyl}-4-methylcyclohex-3-ene-1-carboxylic acid
6-{[2-(3,4-diethoxyphenyl)ethyl]carbamoyl}-4-methylcyclohex-3-ene-1-carboxylic acid
Compound characteristics
| Compound ID: | 8015-0048 |
| Compound Name: | 6-{[2-(3,4-diethoxyphenyl)ethyl]carbamoyl}-4-methylcyclohex-3-ene-1-carboxylic acid |
| Molecular Weight: | 375.46 |
| Molecular Formula: | C21 H29 N O5 |
| Smiles: | CCOc1ccc(CCNC(C2CC(C)=CCC2C(O)=O)=O)cc1OCC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.3541 |
| logD: | -0.0018 |
| logSw: | -2.8444 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.514 |
| InChI Key: | JLDZZDJAVLQKOA-UHFFFAOYSA-N |