Methyl 4-chloro-2,6-bis(phenylsulfanyl)pyrimidine-5-carboxylate

Base Information

• Chemical Name: Methyl 4-chloro-2,6-bis(phenylsulfanyl)pyrimidine-5-carboxylate
• CAS No.: 87847-25-4
• Molecular Formula: C18H13ClN2O2S2
• DSSTox Substance ID: DTXSID90532981
• Wikidata: Q82405982

Synonyms:87847-25-4;Methyl 4-chloro-2,6-bis(phenylthio)pyrimidine-5-carboxylate;DTXSID90532981;Methyl 4-chloro-2,6-bis(phenylsulfanyl)pyrimidine-5-carboxylate

Chemical Property of Methyl 4-chloro-2,6-bis(phenylsulfanyl)pyrimidine-5-carboxylate

Chemical Property:

• XLogP3: 5.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 388.0106977
• Heavy Atom Count: 25
• Complexity: 431

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1=C(N=C(N=C1Cl)SC2=CC=CC=C2)SC3=CC=CC=C3

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