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Zalospirone

Zalospirone structure

Zalospirone 

structure
  • CAS No:

    114298-18-9

  • Formula:

    C24H29N5O2

  • Chemical Name:

    Zalospirone

  • Synonyms:

    4,7-Etheno-1H-cyclobut[f]isoindole-1,3(2H)-dione,3a,4,4a,6a,7,7a-hexahydro-2-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-,(3aR,4R,4aR,6aS,7S,7aS)-rel-;4,7-Etheno-1H-cyclobut[f]isoindole-1,3(2H)-dione,3a,4,4a,6a,7,7a-hexahydro-2-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-,(3aα,4β,4aα,6aα,7β,7aα)-;rel-(3aR,4R,4aR,6aS,7S,7aS)-3a,4,4a,6a,7,7a-Hexahydro-2-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-4,7-etheno-1H-cyclobut[f]isoindole-1,3(2H)-dione;Wy 47846;Zalospirone

Zalospirone Basic Attributes

419.51900

419.52

0449O95Z1J

Characteristics

69.64000

1.53880

1.27g/cm3

652.8ºC

348.6ºC

1.616

0mmHg at 25°C

Drug Information

3a,4,4a,6a,7,7a-hexahydro-2-(4-(4-(2-pyrimidinyl)-1-piperazinyl)butyl)-4,7-etheno-1H-cyclobut(f)isoindole-1,3(2H)-dione

Computed Properties

Molecular Weight:419.5
XLogP3:1.4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:419.23212518
Monoisotopic Mass:419.23212518
Topological Polar Surface Area:69.6
Heavy Atom Count:31
Complexity:743
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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