ethyl 4-[2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate
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ethyl 4-[2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate
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CAS No:
730943-89-2
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Formula:
C14H16F3N5O3S
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Chemical Name:
ethyl 4-[2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate
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Synonyms:
HMS1752I12;ZINC3376313;AKOS034438707;MCULE-6342735788;SR-01000046793;SR-01000046793-1;Z53861424;730943-89-2;ethyl 4-(2-{[4-amino-5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate
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CAS No:
ethyl 4-[2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Basic Attributes
391.37 g/mol
391.09259505 g/mol
Computed Properties
Molecular Weight:391.37
XLogP3:2.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:7
Exact Mass:391.09259505
Monoisotopic Mass:391.09259505
Topological Polar Surface Area:141
Heavy Atom Count:26
Complexity:538
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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