Spectrobid
1-ethoxycarbonyloxyethyl (2S,5R)-6-[[(2R)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;hydrochloride
Also Known As: Spectrobid|Ambacamp|Penglobe|Velbacil|Ambaxin|Bacacil|BAPC|Bacampicillin hydrochloride|EINECS 253-580-4|Bacampicillin hydrochloride [USAN:JAN]|6-[(r)-2-amino-2-phenylacetamido]penicillanic acid[1-(ethoxycarbonyloxy)ethyl] ester monohydrochloride|(2S,5R,6R)-6-((R)-(2-Amino-2-phenylacetamido))-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid ester with ethyl 1-hydroxyethyl carbonate, monohydrochloride|1-((Ethoxycarbonyl)oxy)ethyl (2S-(2alpha,5alpha,6beta(S*)))-6-(2-amino-2-phenylacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate monohydrochloride|1-ethoxycarbonyloxyethyl (2S,5R)-6-[[(2R)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate hydrochloride|4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-((aminophenylacetyl)amino)-3,3-dimethyl-7-oxo-, 1-((ethoxycarbonyl)oxy)ethyl ester, hydrochloride|4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-((aminophenylacetyl)amino)-3,3-dimethyl-7-oxo-, 1-((ethoxycarbonyl)oxy)ethyl ester, monohydrochloride, (2S-(2alpha,5alpha,6beta(S*)))-
| Molecular Formula | C21H28ClN3O7S |
|---|---|
| Molecular Weight | 501.13364 g/mol |
| LogP | 1.72 |
| Topological Polar Surface Area | 137.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 501.13364 |
| Heavy Atoms | 33 |
| Complexity | 901.1 |
Chemical Identifiers
| CAS Number | 39719-58-9 |
|---|---|
| SMILES | CCOC(=O)OC(C)OC(=O)[C@H]1C(S[C@H]2N1C(=O)C2NC(=O)[C@@H](C3=CC=CC=C3)N)(C)C.Cl |
Product Overview
Spectrobid (CAS 39719-58-9), with molecular formula C21H28ClN3O7S and molecular weight 501.13364 g/mol. IUPAC: 1-ethoxycarbonyloxyethyl (2S,5R)-6-[[(2R)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;hydrochloride.
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