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Home > Encyclopedia > Benzonitrile, 4-[3-(2-benzofuranyl)-5,6,7,8-tetrahydropyrazolo[3,4-b]azepin-1(4H)-yl]- (9CI)

Benzonitrile, 4-[3-(2-benzofuranyl)-5,6,7,8-tetrahydropyrazolo[3,4-b]azepin-1(4H)-yl]- (9CI)

Benzonitrile, 4-[3-(2-benzofuranyl)-5,6,7,8-tetrahydropyrazolo[3,4-b]azepin-1(4H)-yl]- (9CI) structure

Benzonitrile, 4-[3-(2-benzofuranyl)-5,6,7,8-tetrahydropyrazolo[3,4-b]azepin-1(4H)-yl]- (9CI) 

structure
  • CAS No:

    582292-26-0

  • Formula:

    C22H18N4O

  • Chemical Name:

    Benzonitrile, 4-[3-(2-benzofuranyl)-5,6,7,8-tetrahydropyrazolo[3,4-b]azepin-1(4H)-yl]- (9CI)

  • Synonyms:

    ZINC3697530;4-[3-(1-benzo[b]furan-2-yl)-5,6,7,8-tetrahydropyrazolo[3,4-b]azepin-1(4H)-yl]benzonitrile

Benzonitrile, 4-[3-(2-benzofuranyl)-5,6,7,8-tetrahydropyrazolo[3,4-b]azepin-1(4H)-yl]- (9CI) Basic Attributes

354.40452

354.148

Characteristics

64.6

3.9

Computed Properties

Molecular Weight:354.4
XLogP3:4.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:354.14806121
Monoisotopic Mass:354.14806121
Topological Polar Surface Area:66.8
Heavy Atom Count:27
Complexity:566
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of Benzonitrile, 4-[3-(2-benzofuranyl)-5,6,7,8-tetrahydropyrazolo[3,4-b]azepin-1(4H)-yl]- (9CI)

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