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

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

CAS No:
797799-65-6
Formula:
C23H21ClN4O3S
Chemical Name:
(E)-3-[2-(azepan-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-(4-chlorophenyl)sulfonylprop-2-enenitrile
Synonyms:
ZINC2197545;STK904646;AKOS005182262;(2E)-3-[2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-[(4-chlorophenyl)sulfonyl]prop-2-enenitrile;(E)-2-[2-(1-azepanyl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-1-[(4-chlorophenyl)sulfonyl]-1-ethenyl cyanide;797799-65-6

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

Molecular Weight：

469.0 g/mol

Exact Mass：

468.1022894 g/mol

Characteristics

PSA：

102 Å²

Computed Properties

Molecular Weight:469.0
XLogP3:3.4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:468.1022894
Monoisotopic Mass:468.1022894
Topological Polar Surface Area:102
Heavy Atom Count:32
Complexity:1070
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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

Basic Attributes
Characteristics
Computed Properties

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