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

Base Information

• Chemical Name: Methyl 2-chloro-4,6-bis(phenylsulfanyl)pyrimidine-5-carboxylate
• CAS No.: 87847-24-3
• Molecular Formula: C18H13ClN2O2S2
• DSSTox Substance ID: DTXSID10532983
• Wikidata: Q82405985

Synonyms:87847-24-3;DTXSID10532983;Methyl 2-chloro-4,6-bis(phenylsulfanyl)pyrimidine-5-carboxylate;Methyl 2-chloro-4,6-bis(phenylthio)pyrimidine-5-carboxylate

Chemical Property of Methyl 2-chloro-4,6-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: 401

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1=C(N=C(N=C1SC2=CC=CC=C2)Cl)SC3=CC=CC=C3

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