Venritidine

Base Information

• Chemical Name: Venritidine
• CAS No.: 93064-63-2
• Molecular Formula: C18H26 N4 O3 S . Cl H
• Molecular Weight: 378.494
• NCI Thesaurus Code: C152853
• Mol file: 93064-63-2.mol

Synonyms:Venritidine;UNII-NP21C25L9S;Venritidine [INN];93064-63-2;NP21C25L9S;(Z)-1-N-methyl-2-nitro-1-N'-[2-[[5-[[[(1S)-3-tricyclo[2.2.1.02,6]heptanyl]amino]methyl]furan-2-yl]methylsulfanyl]ethyl]ethene-1,1-diamine;(+-)-(Z)-N-Methyl-2-nitro-N'-(2-((5-((tricyclo(2.2.1.O(sup 2,6))hept-3-ylamino)methyl)furfuryl)thio)ethyl)-1,1-ethenediamine

Chemical Property of Venritidine

Chemical Property:

• Vapor Pressure: 6.94E-12mmHg at 25°C
• Boiling Point: 543.8°Cat760mmHg
• Flash Point: 282.7°C
• PSA: 120.35000
• Density: 1.3g/cm³
• LogP: 3.83730
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 10
• Exact Mass: 378.17256188
• Heavy Atom Count: 26
• Complexity: 543

Purity/Quality:

VENRITIDINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CNC(=C[N+](=O)[O-])NCCSCC1=CC=C(O1)CNC2C3CC4C2C4C3
• Isomeric SMILES: CN/C(=C/[N+](=O)[O-])/NCCSCC1=CC=C(O1)CNC2C3C[C@@H]4C2C4C3

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