Molecular Identity
TAUROLIDINE
4-[(1,1-dioxo-1,2,4-thiadiazinan-4-yl)methyl]-1,2,4-thiadiazinane 1,1-dioxide
PubChem CID: 29566
Taurolidine is a member of the class of thiadiazinanes that is 1,2,4-thiadiazinane 1,1-dioxide substituted by a (1,1-dioxido-1,2,4-thiadiazinan-4-yl)methyl group at position 4. It is a broad-spectrum antiseptic used as lock therapy solution in patients with long term central venous catheters for the prevention of catheter related bloodstream infections. It has a role as an antibacterial agent, an antineoplastic agent, an antifungal agent, an antiseptic drug and an anti-inflammatory agent. It is a sulfone and a thiadiazinane.
2D Structure
Properties
C7H16N4O4S2
Molecular Formula
284.40
Molecular Weight
g/mol
284.0613
Exact Mass
Da
-1.7
XLogP
Drug-like (Lipinski: < 5)
116
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
8
H-Bond Acceptors
419
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
TAUROLIDINE19388-87-5TaurolinTaurolineTaurolidinaTaurolidinumCyclo-taurolidine(cyclo)-taurolidine4-[(1,1-dioxo-1,2,4-thiadiazinan-4-yl)methyl]-1,2,4-thiadiazinane 1,1-dioxide8OBZ1M4V3VW-3100MDTXSID00173001DEFENCATH COMPONENT TAUROLIDINETAUROLOCK COMPONENT TAUROLIDINE4-((1,1-dioxo-1,2,4-thiadiazinan-4-yl)methyl)-1,2,4-thiadiazinane 1,1-dioxide
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to TAUROLIDINE
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