3-[(acetyloxy)methyl]-7-butanamido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Chemical Structure Depiction of
3-[(acetyloxy)methyl]-7-butanamido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
3-[(acetyloxy)methyl]-7-butanamido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Compound characteristics
| Compound ID: | Y502-5997 |
| Compound Name: | 3-[(acetyloxy)methyl]-7-butanamido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid |
| Molecular Weight: | 342.37 |
| Molecular Formula: | C14 H18 N2 O6 S |
| Smiles: | CCCC(NC1C2N(C(=C(COC(C)=O)CS2)C(O)=O)C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.1129 |
| logD: | -5.5138 |
| logSw: | -1.6668 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.007 |
| InChI Key: | DJLOKMQBWZXCBH-UHFFFAOYSA-N |