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Home > Encyclopedia > 8-[4-(4-fluorophenyl)-4-oxobutyl]-3-[2-(4-isothiocyanatophenyl)ethyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one

8-[4-(4-fluorophenyl)-4-oxobutyl]-3-[2-(4-isothiocyanatophenyl)ethyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one

8-[4-(4-fluorophenyl)-4-oxobutyl]-3-[2-(4-isothiocyanatophenyl)ethyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one structure

8-[4-(4-fluorophenyl)-4-oxobutyl]-3-[2-(4-isothiocyanatophenyl)ethyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one 

structure
  • CAS No:

    135261-88-0

  • Formula:

    C32H33FN4O2S

  • Chemical Name:

    8-[4-(4-fluorophenyl)-4-oxobutyl]-3-[2-(4-isothiocyanatophenyl)ethyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one

  • Synonyms:

    N-(4-isothiocyanatophenethyl)spiperone;NIPS;135261-88-0;NIPS;Lopac-N-140;Lopac0_000870;CHEMBL1257081;DTXSID10928928;ZINC4475312;N-(4-Isothiocyanatophenethyl)spiperone;CCG-204952;NCGC00015711-01;N-(P-Isothiocyanatophenethyl)Spiperone HCl;8-[3-(4-Fluorobenzoyl)propyl]-1-phenyl-3-[4-(isothiocyanato)phenethyl]-1,3,8-triazaspiro[4.5]decan-4-one;8-[4-(4-Fluorophenyl)-4-oxobutyl]-3-[2-(4-isothiocyanatophenyl)ethyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-onato;8-[4-(4-fluorophenyl)-4-oxobutyl]-3-[2-(4-isothiocyanatophenyl)ethyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one

8-[4-(4-fluorophenyl)-4-oxobutyl]-3-[2-(4-isothiocyanatophenyl)ethyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one Basic Attributes

556.7 g/mol

556.23082564 g/mol

430-370-2

Characteristics

88.3 Ų

Drug Information

N-(4-isothiocyanatophenethyl)spiperone

Computed Properties

Molecular Weight:556.7
XLogP3:7
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:556.23082564
Monoisotopic Mass:556.23082564
Topological Polar Surface Area:88.3
Heavy Atom Count:40
Complexity:897
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 8-[4-(4-fluorophenyl)-4-oxobutyl]-3-[2-(4-isothiocyanatophenyl)ethyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one

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