3-[(4-chloro-2,5-dimethoxyphenyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Chemical Structure Depiction of
3-[(4-chloro-2,5-dimethoxyphenyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid
3-[(4-chloro-2,5-dimethoxyphenyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Compound characteristics
| Compound ID: | Y204-6256 |
| Compound Name: | 3-[(4-chloro-2,5-dimethoxyphenyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid |
| Molecular Weight: | 353.76 |
| Molecular Formula: | C16 H16 Cl N O6 |
| Smiles: | COc1cc(c(cc1NC(C1C(C2C=CC1O2)C(O)=O)=O)OC)[Cl] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.9346 |
| logD: | -0.2868 |
| logSw: | -2.6224 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.925 |
| InChI Key: | LHMHDOPIYYXELT-UHFFFAOYSA-N |