(E)-3-[2-(azepan-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-(benzenesulfonyl)prop-2-enenitrile
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![(E)-3-[2-(azepan-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-(benzenesulfonyl)prop-2-enenitrile structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/a65e715a00254103b50d17076ef19e88.png "(E)-3-[2-(azepan-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-(benzenesulfonyl)prop-2-enenitrile")
(E)-3-[2-(azepan-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-(benzenesulfonyl)prop-2-enenitrile
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CAS No:
799771-46-3
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Formula:
C23H22N4O3S
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Chemical Name:
(E)-3-[2-(azepan-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-(benzenesulfonyl)prop-2-enenitrile
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Synonyms:
ZINC2204698;STK904125;AKOS005182609;(2E)-3-[2-(azepan-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-(phenylsulfonyl)prop-2-enenitrile;(E)-2-[2-(1-azepanyl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-1-(phenylsulfonyl)-1-ethenyl cyanide;799771-46-3
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CAS No:
(E)-3-[2-(azepan-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-(benzenesulfonyl)prop-2-enenitrile Basic Attributes
434.5 g/mol
434.14126175 g/mol
Computed Properties
Molecular Weight:434.5
XLogP3:2.8
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:434.14126175
Monoisotopic Mass:434.14126175
Topological Polar Surface Area:102
Heavy Atom Count:31
Complexity:1040
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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