Avagard
(1E)-2-[6-[[amino-[(E)-[amino-(4-chloroanilino)methylidene]amino]methylidene]amino]hexyl]-1-[amino-(4-chloroanilino)methylidene]guanidine;ethanol;bis((2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid)
Molecular Identity
Avagard
(1E)-2-[6-[[amino-[(E)-[amino-(4-chloroanilino)methylidene]amino]methylidene]amino]hexyl]-1-[amino-(4-chloroanilino)methylidene]guanidine;ethanol;bis((2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid)
PubChem CID: 133065413
2D Structure
Properties
C36H60Cl2N10O15
Molecular Formula
943.80
Molecular Weight
g/mol
942.3617
Exact Mass
Da
475
TPSA
May have limited oral absorption
19
H-Bond Donors
17
H-Bond Acceptors
822
Complexity
SMILES
Canonical SMILES
SMILES: CCO.C1=CC(=CC=C1NC(=NC(=NCCCCCCN=C(N)N=C(N)NC2=CC=C(C=C2)Cl)N)N)Cl.C(C(C(C(C(C(=O)O)O)O)O)O)O.C(C(C(C(C(C(=O)O)O)O)O)O)OIsomeric SMILES
SMILES: CCO.C1=CC(=CC=C1N/C(=N/C(=NCCCCCCN=C(/N=C(/NC2=CC=C(C=C2)Cl)\N)N)N)/N)Cl.C(O)[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C(=O)O.C(O)[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C(=O)OSynonyms(5)
AVAGARDChlorhexidine gluconate / ethanolChlorhexidine bigluconate / ethanolChlorhexidine digluconate / ethanol100830-89-5
Data from PubChem (NCBI)
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