Tedral

Base Information

• Chemical Name: Tedral
• CAS No.: 8057-98-5
• Molecular Formula: C29H36ClN7O6
• Molecular Weight: 614.09244
• DSSTox Substance ID: DTXSID80230404
• Mol file: 8057-98-5.mol

Synonyms:ephedrine - phenobarbital - theophylline;ephedrine, phenobarbital, theophylline drug combination;Tedral;tedralan

Chemical Property of Tedral

Chemical Property:

• PSA: 187.19000
• LogP: 2.73330
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 5
• Exact Mass: 613.2415596
• Heavy Atom Count: 43
• Complexity: 727

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1(C(=O)NC(=O)NC1=O)C2=CC=CC=C2.CC(C(C1=CC=CC=C1)O)NC.CN1C2=C(C(=O)N(C1=O)C)NC=N2.Cl
• Isomeric SMILES: CCC1(C(=O)NC(=O)NC1=O)C2=CC=CC=C2.C[C@@H]([C@@H](C1=CC=CC=C1)O)NC.CN1C2=C(C(=O)N(C1=O)C)NC=N2.Cl