3-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamoyl}-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Chemical Structure Depiction of
3-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamoyl}-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
3-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamoyl}-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Compound characteristics
| Compound ID: | Y205-0153 |
| Compound Name: | 3-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]carbamoyl}-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid |
| Molecular Weight: | 423.28 |
| Molecular Formula: | C17 H15 Br N2 O4 S |
| Smiles: | C1CC2C(C(C1O2)C(O)=O)C(Nc1nc(cs1)c1ccc(cc1)[Br])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.7132 |
| logD: | 3.1973 |
| logSw: | -5.8164 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.137 |
| InChI Key: | XCCBLJLLIOMBMK-UHFFFAOYSA-N |