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Home > Encyclopedia > 3-(1,4-DIAZEPAN-1-YL)BENZO[D]ISOTHIAZOLE

3-(1,4-DIAZEPAN-1-YL)BENZO[D]ISOTHIAZOLE

3-(1,4-DIAZEPAN-1-YL)BENZO[D]ISOTHIAZOLE structure

3-(1,4-DIAZEPAN-1-YL)BENZO[D]ISOTHIAZOLE 

structure
  • CAS No:

    99748-44-4

  • Formula:

    C12H15N3S

  • Chemical Name:

    3-(1,4-DIAZEPAN-1-YL)BENZO[D]ISOTHIAZOLE

  • Synonyms:

    3-(1,4-Diazepan-1-yl)benzo[d]isothiazole;3-(1,4-Diazepan-1-yl)-1,2-benzothiazole;SCHEMBL9722339;CTK5I0644;DTXSID60544036;1,2-Benzisothiazole, 3-(hexahydro-1H-1,4-diazepin-1-yl)-;BBL036721;STL559100;ZINC34091287;AKOS002435319

3-(1,4-DIAZEPAN-1-YL)BENZO[D]ISOTHIAZOLE Basic Attributes

233.3326

233.099

DTXSID60544036

Characteristics

56.4

2.5

Computed Properties

Molecular Weight:233.33
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:233.09866866
Monoisotopic Mass:233.09866866
Topological Polar Surface Area:56.4
Heavy Atom Count:16
Complexity:236
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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