Blp 875
(2R,5R,6R)-6-[(2-amino-2-thiophen-3-ylacetyl)amino]-3-methylidene-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Also Known As: BLP 875|6-(R-alpha-Amino-3-thienylacetamido)penicillanic acid|4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-((amino-3-thienylacetyl)amino)-3-methylene-7-oxo-, (2S-(2-alpha,5-alpha,6-beta(S*)))-, trihydrate|(2R,5R,6R)-6-[(2-amino-2-thiophen-3-yl-acetyl)amino]-3-methylidene-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid|(2R,5R,6R)-6-[(2-amino-2-thiophen-3-ylacetyl)amino]-3-methylidene-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid|(2R,5R,6R)-6-[2-AMINO-2-(THIOPHEN-3-YL)ACETAMIDO]-3-METHYLIDENE-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE-2-CARBOXYLIC ACID
| Molecular Formula | C13H13N3O4S2 |
|---|---|
| Molecular Weight | 339.03476 g/mol |
| LogP | 0.1147 |
| Topological Polar Surface Area | 112.73 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 339.03476 |
| Monoisotopic Mass | 339.03476 |
| Heavy Atoms | 22 |
| Complexity | 660.2523 |
Chemical Identifiers
| CAS Number | 63504-05-2 |
|---|---|
| SMILES | C=C1[C@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)C(C3=CSC=C3)N)C(=O)O |
Product Overview
Blp 875 (CAS 63504-05-2), with molecular formula C13H13N3O4S2 and molecular weight 339.03476 g/mol. IUPAC: (2R,5R,6R)-6-[(2-amino-2-thiophen-3-ylacetyl)amino]-3-methylidene-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid.