2-[2-(5-Methyl-4-imidazolylmethylthio)ethylamino]-3-nitropyrrole

Base Information

• Chemical Name: 2-[2-(5-Methyl-4-imidazolylmethylthio)ethylamino]-3-nitropyrrole
• CAS No.: 74188-69-5
• Molecular Formula: C11H15N5O2S
• ChEMBL ID: CHEMBL359183
• DSSTox Substance ID: DTXSID10876495
• Nikkaji Number: J1.586.764G
• Wikidata: Q82858140

Synonyms:74188-69-5;CHEMBL359183;SCHEMBL10860622;DTXSID10876495;WSMQAYKMXMFXKP-UHFFFAOYSA-N;1H-PYRROL-2-AMINE, N-[2-[[(5-METHYL-1H-IMIDAZOL-;2-[2-(5-methyl-4-imidazolylmethylthio)ethylamino]-3-nitropyrrole

Chemical Property of 2-[2-(5-Methyl-4-imidazolylmethylthio)ethylamino]-3-nitropyrrole

Chemical Property:

• XLogP3: 1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 281.09464591
• Heavy Atom Count: 19
• Complexity: 301

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(N=CN1)CSCCNC2=C(C=CN2)[N+](=O)[O-]

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