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Home > Encyclopedia > methyl 5-[[4-oxo-3-[3-(trifluoromethyl)phenyl]-5H-pyrimido[5,4-b]indol-2-yl]sulfanylmethyl]furan-2-carboxylate

methyl 5-[[4-oxo-3-[3-(trifluoromethyl)phenyl]-5H-pyrimido[5,4-b]indol-2-yl]sulfanylmethyl]furan-2-carboxylate

methyl 5-[[4-oxo-3-[3-(trifluoromethyl)phenyl]-5H-pyrimido[5,4-b]indol-2-yl]sulfanylmethyl]furan-2-carboxylate structure

methyl 5-[[4-oxo-3-[3-(trifluoromethyl)phenyl]-5H-pyrimido[5,4-b]indol-2-yl]sulfanylmethyl]furan-2-carboxylate 

structure
  • CAS No:

    536716-42-4

  • Formula:

    C24H16F3N3O4S

  • Chemical Name:

    methyl 5-[[4-oxo-3-[3-(trifluoromethyl)phenyl]-5H-pyrimido[5,4-b]indol-2-yl]sulfanylmethyl]furan-2-carboxylate

  • Synonyms:

    methyl 5-(((4-oxo-3-(3-(trifluoromethyl)phenyl)-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)thio)methyl)furan-2-carboxylate;536716-42-4;ZINC2720953;AKOS002052710;MCULE-4111415858;methyl 5-[[4-oxo-3-[3-(trifluoromethyl)phenyl]-5H-pyrimido[5,4-b]indol-2-yl]sulfanylmethyl]furan-2-carboxylate;F0580-1015;methyl 5-[({4-oxo-3-[3-(trifluoromethyl)phenyl]-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl}thio)methyl]-2-furoate

methyl 5-[[4-oxo-3-[3-(trifluoromethyl)phenyl]-5H-pyrimido[5,4-b]indol-2-yl]sulfanylmethyl]furan-2-carboxylate Basic Attributes

499.5 g/mol

499.08136166 g/mol

Characteristics

113 Ų

Computed Properties

Molecular Weight:499.5
XLogP3:5.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:6
Exact Mass:499.08136166
Monoisotopic Mass:499.08136166
Topological Polar Surface Area:113
Heavy Atom Count:35
Complexity:856
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of methyl 5-[[4-oxo-3-[3-(trifluoromethyl)phenyl]-5H-pyrimido[5,4-b]indol-2-yl]sulfanylmethyl]furan-2-carboxylate

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