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Home > Encyclopedia > 1,3-benzothiazol-2-yl 4-oxo-4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl sulfide

1,3-benzothiazol-2-yl 4-oxo-4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl sulfide

1,3-benzothiazol-2-yl 4-oxo-4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl sulfide structure

1,3-benzothiazol-2-yl 4-oxo-4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl sulfide 

structure
  • CAS No:

    696635-63-9

  • Formula:

    C19H21N5OS2

  • Chemical Name:

    1,3-benzothiazol-2-yl 4-oxo-4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl sulfide

  • Synonyms:

    4-(1,3-benzothiazol-2-ylsulfanyl)-1-[4-(pyrimidin-2-yl)piperazin-1-yl]butan-1-one;HMS1733J18;ZINC4694558;STK664479;AKOS001176738;MCULE-7147025675;AO-080/43378530;Z26444950;1,3-benzothiazol-2-yl 4-oxo-4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl sulfide;2-{[4-oxo-4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]thio}-1,3-benzothiazole

1,3-benzothiazol-2-yl 4-oxo-4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl sulfide Basic Attributes

399.53294

399.119

Characteristics

116

3.2

Computed Properties

Molecular Weight:399.5
XLogP3:3.2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:399.11875266
Monoisotopic Mass:399.11875266
Topological Polar Surface Area:116
Heavy Atom Count:27
Complexity:483
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 1,3-benzothiazol-2-yl 4-oxo-4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl sulfide

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