2,2,2-trichloroethyl 3-methyl-8-oxo-7-(2-phenylacetamido)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Chemical Structure Depiction of
2,2,2-trichloroethyl 3-methyl-8-oxo-7-(2-phenylacetamido)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
2,2,2-trichloroethyl 3-methyl-8-oxo-7-(2-phenylacetamido)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Compound characteristics
| Compound ID: | 3013-0057 |
| Compound Name: | 2,2,2-trichloroethyl 3-methyl-8-oxo-7-(2-phenylacetamido)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate |
| Molecular Weight: | 463.77 |
| Molecular Formula: | C18 H17 Cl3 N2 O4 S |
| Smiles: | CC1CSC2C(C(N2C=1C(=O)OCC([Cl])([Cl])[Cl])=O)NC(Cc1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4206 |
| logD: | 3.4206 |
| logSw: | -3.8576 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.225 |
| InChI Key: | DYSKJEHQMVZZTP-UHFFFAOYSA-N |