6-[(2-bromophenyl)carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
Chemical Structure Depiction of
6-[(2-bromophenyl)carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
6-[(2-bromophenyl)carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
Compound characteristics
| Compound ID: | Y204-7397 |
| Compound Name: | 6-[(2-bromophenyl)carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylic acid |
| Molecular Weight: | 352.23 |
| Molecular Formula: | C16 H18 Br N O3 |
| Smiles: | CC1CC(C(CC=1C)C(Nc1ccccc1[Br])=O)C(O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.0544 |
| logD: | 0.6985 |
| logSw: | -3.2384 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.232 |
| InChI Key: | GHBCAJPWQIFSMU-UHFFFAOYSA-N |