SK&F 80000
(6R,7R)-7-[[(2E)-2-hydroxyimino-2-phenylacetyl]amino]-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Also Known As: Skf 80000|SK&F 80000|SK&F-80000|(6R,7R)-7-[[(2E)-2-hydroxyimino-2-phenylacetyl]amino]-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid|5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(((hydroxyimino)phenylacetyl)amino)-3-(((1-methyl-1H-tetrazol-5-yl)thio)methyl)-8-oxo-, (6R-(6alpha,7beta(Z)))-
| Molecular Formula | C18H17N7O5S2 |
|---|---|
| Molecular Weight | 475.07327 g/mol |
| LogP | -0.0807 |
| Topological Polar Surface Area | 162.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 475.07327 |
| Monoisotopic Mass | 475.07327 |
| Heavy Atoms | 32 |
| Complexity | 1133.7482 |
Chemical Identifiers
| CAS Number | 61606-60-8 |
|---|---|
| SMILES | CN1C(=NN=N1)SCC2=C(N3[C@@H]([C@@H](C3=O)NC(=O)/C(=N/O)/C4=CC=CC=C4)SC2)C(=O)O |
Product Overview
SK&F 80000 (CAS 61606-60-8), with molecular formula C18H17N7O5S2 and molecular weight 475.07327 g/mol. IUPAC: (6R,7R)-7-[[(2E)-2-hydroxyimino-2-phenylacetyl]amino]-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid.