methyl 2-[[1,1,1,3,3,3-hexafluoro-2-[(2-phenylacetyl)amino]propan-2-yl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
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methyl 2-[[1,1,1,3,3,3-hexafluoro-2-[(2-phenylacetyl)amino]propan-2-yl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
structure -
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CAS No:
524717-00-8
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Formula:
C22H22F6N2O3S
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Chemical Name:
methyl 2-[[1,1,1,3,3,3-hexafluoro-2-[(2-phenylacetyl)amino]propan-2-yl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
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Synonyms:
ZINC2448189;STK772431;AKOS003295298;MCULE-8463245595;524717-00-8;methyl 2-({1,1,1,3,3,3-hexafluoro-2-[(phenylacetyl)amino]propan-2-yl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
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CAS No:
methyl 2-[[1,1,1,3,3,3-hexafluoro-2-[(2-phenylacetyl)amino]propan-2-yl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate Basic Attributes
508.5 g/mol
508.12553271 g/mol
Computed Properties
Molecular Weight:508.5
XLogP3:7.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:7
Exact Mass:508.12553271
Monoisotopic Mass:508.12553271
Topological Polar Surface Area:95.7
Heavy Atom Count:34
Complexity:712
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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