7-(2-chlorobenzamido)-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Chemical Structure Depiction of
7-(2-chlorobenzamido)-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
7-(2-chlorobenzamido)-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Compound characteristics
| Compound ID: | D177-1133 |
| Compound Name: | 7-(2-chlorobenzamido)-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid |
| Molecular Weight: | 352.79 |
| Molecular Formula: | C15 H13 Cl N2 O4 S |
| Smiles: | CC1CSC2C(C(N2C=1C(O)=O)=O)NC(c1ccccc1[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.1496 |
| logD: | -2.7472 |
| logSw: | -2.9765 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.718 |
| InChI Key: | KAQSYOBVGLVJFK-UHFFFAOYSA-N |