3-[(2-bromo-4-methylphenyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Chemical Structure Depiction of
3-[(2-bromo-4-methylphenyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
3-[(2-bromo-4-methylphenyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Compound characteristics
| Compound ID: | Y204-0900 |
| Compound Name: | 3-[(2-bromo-4-methylphenyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid |
| Molecular Weight: | 350.21 |
| Molecular Formula: | C16 H16 Br N O3 |
| Smiles: | Cc1ccc(c(c1)[Br])NC(C1C2CC(C=C2)C1C(O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.2223 |
| logD: | 0.8971 |
| logSw: | -3.1142 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.885 |
| InChI Key: | DJNCYVJSNFIMKE-UHFFFAOYSA-N |