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(E)-3-[2-(4-benzylpiperazin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-(4-methylphenyl)sulfonylprop-2-enenitrile

(E)-3-[2-(4-benzylpiperazin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-(4-methylphenyl)sulfonylprop-2-enenitrile structure

CAS No:
799768-90-4
Formula:
C29H27N5O3S
Chemical Name:
(E)-3-[2-(4-benzylpiperazin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-(4-methylphenyl)sulfonylprop-2-enenitrile
Synonyms:
MLS001147814;CHEMBL1711335;HMS2943N07;STK881786;ZINC20170543;AKOS005181656;SMR000646993;(2E)-3-[2-(4-benzylpiperazin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-[(4-methylphenyl)sulfonyl]prop-2-enenitrile;799768-90-4

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(E)-3-[2-(4-benzylpiperazin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-(4-methylphenyl)sulfonylprop-2-enenitrile Basic Attributes

Molecular Weight：

525.6 g/mol

Exact Mass：

525.18346091 g/mol

Characteristics

PSA：

106 Å²

Computed Properties

Molecular Weight:525.6
XLogP3:3.3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:525.18346091
Monoisotopic Mass:525.18346091
Topological Polar Surface Area:106
Heavy Atom Count:38
Complexity:1220
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (E)-3-[2-(4-benzylpiperazin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-(4-methylphenyl)sulfonylprop-2-enenitrile

Basic Attributes
Characteristics
Computed Properties

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