(E)-N-(1-hydroxy-3-methylsulfanylpropan-2-yl)-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)prop-2-enamide

Base Information

• Chemical Name: (E)-N-(1-hydroxy-3-methylsulfanylpropan-2-yl)-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)prop-2-enamide
• CAS No.: 61827-19-8
• Molecular Formula: C12H17N3O4S
• Molecular Weight: 299.3461
• NSC Number: 233872,217345
• DSSTox Substance ID: DTXSID60417695
• ChEMBL ID: CHEMBL1999874
• Mol file: 61827-19-8.mol

Synonyms:NSC233872;61827-19-8;CHEMBL1999874;DTXSID60417695;NSC217345;NSC-217345;NSC-233872;PD011471

Chemical Property of (E)-N-(1-hydroxy-3-methylsulfanylpropan-2-yl)-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)prop-2-enamide

Chemical Property:

• Density: 1.357g/cm³
• XLogP3: -0.8
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 299.09397721
• Heavy Atom Count: 20
• Complexity: 473

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=O)NC(=O)N1)C=CC(=O)NC(CO)CSC
• Isomeric SMILES: CC1=C(C(=O)NC(=O)N1)/C=C/C(=O)NC(CO)CSC