L-Prolinamide, N-((hexahydro-2,6-dioxo-1-propyl-4-pyrimidinyl)carbonyl)-L-histidyl-, (S)-, hydrate (2:3)

Base Information

• Chemical Name: L-Prolinamide, N-((hexahydro-2,6-dioxo-1-propyl-4-pyrimidinyl)carbonyl)-L-histidyl-, (S)-, hydrate (2:3)
• CAS No.: 128056-03-1
• Molecular Formula: C19H27 N7 O5
• Molecular Weight: 433.4616
• DSSTox Substance ID: DTXSID50155791
• Wikidata: Q76279697
• Mol file: 128056-03-1.mol

Synonyms:128056-03-1;L-Prolinamide, N-((hexahydro-2,6-dioxo-1-propyl-4-pyrimidinyl)carbonyl)-L-histidyl-, (S)-, hydrate (2:3);DTXSID50155791;C19H27N7O5.3/2H2O;LS-118844;C19-H27-N7-O5.3/2H2-O

Chemical Property of L-Prolinamide, N-((hexahydro-2,6-dioxo-1-propyl-4-pyrimidinyl)carbonyl)-L-histidyl-, (S)-, hydrate (2:3)

Chemical Property:

• Density: 1.379g/cm³
• XLogP3: -2.1
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 8
• Exact Mass: 433.20736699
• Heavy Atom Count: 31
• Complexity: 745

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCN1C(=O)CC(NC1=O)C(=O)NC(CC2=CN=CN2)C(=O)N3CCCC3C(=O)N
• Isomeric SMILES: CCCN1C(=O)C[C@H](NC1=O)C(=O)N[C@@H](CC2=CN=CN2)C(=O)N3CCC[C@H]3C(=O)N

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