Pivampicillin probenate

2,2-dimethylpropanoyloxymethyl (2S,5R,6R)-6-[[(2R)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;4-(dipropylsulfamoyl)benzoic acid

CAS: 42190-91-0

Molecular Formula	`C35H48N4O10S2`
Molecular Weight	748.9 g/mol
Topological Polar Surface Area	236.0 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	13
Rotatable Bonds	16
Exact Mass	748.2812
Heavy Atoms	51
Complexity	1150.0

Chemical Identifiers

CAS Number	42190-91-0
SMILES	`CCCN(CCC)S(=O)(=O)C1=CC=C(C=C1)C(=O)O.CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)N)C(=O)OCOC(=O)C(C)(C)C)C`
InChIKey	`LKZFWYIOFQDUMO-GLCLSGQWSA-N`

📖 Product Overview

Pivampicillin probenate (CAS: 42190-91-0) is a chemical compound with molecular formula C35H48N4O10S2 and molecular weight 748.9 g/mol. Its IUPAC systematic name is 2,2-dimethylpropanoyloxymethyl (2S,5R,6R)-6-[[(2R)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;4-(dipropylsulfamoyl)benzoic acid. Topological Polar Surface Area 236.0 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 13 Rotatable Bonds 16 Exact Mass 748.2812 Heavy Atoms 51 Complexity 1150.0 InChI Key: LKZFWYIOFQDUMO-GLCLSGQWSA-N. SMILES: CCCN(CCC)S(=O)(=O)C1=CC=C(C=C1)C(=O)O.CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)N)C(=O)OCOC(=O)C(C)(C)C)C.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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