Ethyl 4-[(4-bromophenyl)sulfanyl]-2-(methylsulfanyl)-5-pyrimidinecarboxylate

Base Information

• Chemical Name: Ethyl 4-[(4-bromophenyl)sulfanyl]-2-(methylsulfanyl)-5-pyrimidinecarboxylate
• CAS No.: 339019-48-6
• Molecular Formula: C14H13BrN2O2S2
• Molecular Weight: 385.3
• DSSTox Substance ID: DTXSID401159131
• Mol file: 339019-48-6.mol

Synonyms:339019-48-6;ethyl 4-[(4-bromophenyl)sulfanyl]-2-(methylsulfanyl)-5-pyrimidinecarboxylate;ethyl 4-[(4-bromophenyl)sulfanyl]-2-(methylsulfanyl)pyrimidine-5-carboxylate;ethyl 4-(4-bromophenyl)sulfanyl-2-methylsulfanylpyrimidine-5-carboxylate;Bionet1_003265;HMS577P07;DTXSID401159131;AKOS005100657;7N-515S;Ethyl 4-[(4-bromophenyl)thio]-2-(methylthio)-5-pyrimidinecarboxylate;ethyl4-[(4-bromophenyl)sulfanyl]-2-(methylsulfanyl)pyrimidine-5-carboxylate

Chemical Property of Ethyl 4-[(4-bromophenyl)sulfanyl]-2-(methylsulfanyl)-5-pyrimidinecarboxylate

Chemical Property:

• PKA: -1.25±0.40(Predicted)
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 383.96018
• Heavy Atom Count: 21
• Complexity: 341

Purity/Quality:

Ethyl 4-[(4-bromophenyl)sulfanyl]-2-(methylsulfanyl)-5-pyrimidinecarboxylate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: CCOC(=O)C1=CN=C(N=C1SC2=CC=C(C=C2)Br)SC