L-Prolinamide, N-((hexahydro-1-methyl-2,6-dioxo-4-pyrimidinyl)carbonyl)-L-histidyl-N,N-dimethyl-, hydrate (4:5)

Base Information

• Chemical Name: L-Prolinamide, N-((hexahydro-1-methyl-2,6-dioxo-4-pyrimidinyl)carbonyl)-L-histidyl-N,N-dimethyl-, hydrate (4:5)
• CAS No.: 128055-85-6
• Molecular Formula: C19H27 N7 O5
• Molecular Weight: 433.4616
• DSSTox Substance ID: DTXSID90926063
• Mol file: 128055-85-6.mol

Synonyms:128055-85-6;L-Prolinamide, N-((hexahydro-1-methyl-2,6-dioxo-4-pyrimidinyl)carbonyl)-L-histidyl-N,N-dimethyl-, hydrate (4:5);DTXSID90926063;C19H27N7O5.5/4H2O;LS-118850;C19-H27-N7-O5.5/4H2-O;2-Hydroxy-N-{3-(1H-imidazol-5-yl)-1-[methyl(1-methylpyrrolidine-2-carbonyl)amino]-1-oxopropan-2-yl}-1-methyl-6-oxo-1,4,5,6-tetrahydropyrimidine-4-carboximidic acid

Chemical Property of L-Prolinamide, N-((hexahydro-1-methyl-2,6-dioxo-4-pyrimidinyl)carbonyl)-L-histidyl-N,N-dimethyl-, hydrate (4:5)

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 1.358g/cm³
• XLogP3: -1.5
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 6
• Exact Mass: 433.20736699
• Heavy Atom Count: 31
• Complexity: 760

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CCCC1C(=O)N(C)C(=O)C(CC2=CN=CN2)NC(=O)C3CC(=O)N(C(=O)N3)C
• Isomeric SMILES: CN1CCC[C@H]1C(=O)N(C)C(=O)[C@H](CC2=CN=CN2)NC(=O)C3CC(=O)N(C(=O)N3)C

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