 Home > Encyclopedia > 5-(4-benzylpiperidin-1-yl)-2-[(E)-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,3-oxazole-4-carbonitrile

5-(4-benzylpiperidin-1-yl)-2-[(E)-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,3-oxazole-4-carbonitrile

5-(4-benzylpiperidin-1-yl)-2-[(E)-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,3-oxazole-4-carbonitrile structure

CAS No:
845632-20-4
Formula:
C21H20N4O2S2
Chemical Name:
5-(4-benzylpiperidin-1-yl)-2-[(E)-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,3-oxazole-4-carbonitrile
Synonyms:
ZINC9281329;STL201032;AKOS005183604;5-(4-benzylpiperidin-1-yl)-2-[(E)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-1,3-oxazole-4-carbonitrile;5-(4-benzylpiperidino)-2-[(3-methyl-4-oxo-2-thioxo-1,3-thiazolan-5-yliden)methyl]-1,3-oxazol-4-yl cyanide;845632-20-4

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5-(4-benzylpiperidin-1-yl)-2-[(E)-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,3-oxazole-4-carbonitrile Basic Attributes

Molecular Weight：

424.5 g/mol

Exact Mass：

424.10276824 g/mol

Characteristics

PSA：

131 Å²

Computed Properties

Molecular Weight:424.5
XLogP3:4.6
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:424.10276824
Monoisotopic Mass:424.10276824
Topological Polar Surface Area:131
Heavy Atom Count:29
Complexity:719
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-(4-benzylpiperidin-1-yl)-2-[(E)-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,3-oxazole-4-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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