3-[(acetyloxy)methyl]-7-({5-[(4-methoxyphenoxy)methyl]furan-2-carbonyl}amino)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Chemical Structure Depiction of
3-[(acetyloxy)methyl]-7-({5-[(4-methoxyphenoxy)methyl]furan-2-carbonyl}amino)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
3-[(acetyloxy)methyl]-7-({5-[(4-methoxyphenoxy)methyl]furan-2-carbonyl}amino)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Compound characteristics
| Compound ID: | Y502-3213 |
| Compound Name: | 3-[(acetyloxy)methyl]-7-({5-[(4-methoxyphenoxy)methyl]furan-2-carbonyl}amino)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid |
| Molecular Weight: | 502.5 |
| Molecular Formula: | C23 H22 N2 O9 S |
| Smiles: | CC(=O)OCC1CSC2C(C(N2C=1C(O)=O)=O)NC(c1ccc(COc2ccc(cc2)OC)o1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.9027 |
| logD: | -3.724 |
| logSw: | -2.3963 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 113.561 |
| InChI Key: | JSTZNMSVBVDXIM-UHFFFAOYSA-N |