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3-(pyrrolidin-1-ylmethyl)-1,3-benzothiazole-2-thione

3-(pyrrolidin-1-ylmethyl)-1,3-benzothiazole-2-thione structure

CAS No:
23124-36-9
Formula:
C12H14N2S2
Chemical Name:
3-(pyrrolidin-1-ylmethyl)-1,3-benzothiazole-2-thione
Synonyms:
NSC659445;3-(1-Pyrrolidinylmethyl)-1,3-benzothiazole-2(3H)-thione;3-(pyrrolidin-1-ylmethyl)-1,3-benzothiazole-2-thione;3-pyrrolidin-1-ylmethyl-3H-benzothiazole-2-thione;SCHEMBL9628249;ZINC19800677;AKOS024345650;MCULE-7549813796;NSC-659445;23124-36-9;3-(pyrrolidin-1-ylmethyl)-2,3-dihydro-1,3-benzothiazole-2-thione

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3-(pyrrolidin-1-ylmethyl)-1,3-benzothiazole-2-thione Basic Attributes

Molecular Weight：

250.4 g/mol

Exact Mass：

250.05984080 g/mol

NSC Number：

659445

Characteristics

PSA：

63.9 Å²

XLogP3：

3.4235

Melting Point：

127 °C

Computed Properties

Molecular Weight:250.4
XLogP3:3.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:250.05984080
Monoisotopic Mass:250.05984080
Topological Polar Surface Area:63.9
Heavy Atom Count:16
Complexity:276
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(pyrrolidin-1-ylmethyl)-1,3-benzothiazole-2-thione

Basic Attributes
Characteristics
Computed Properties

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