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2-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl]sulfanyl-3-benzyl-7-chloroquinazolin-4-one
2-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl]sulfanyl-3-benzyl-7-chloroquinazolin-4-one
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![2-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl]sulfanyl-3-benzyl-7-chloroquinazolin-4-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/991d046eeacf41bf8d32221712d276d6.png "2-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl]sulfanyl-3-benzyl-7-chloroquinazolin-4-one")
2-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl]sulfanyl-3-benzyl-7-chloroquinazolin-4-one
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CAS No:
796054-49-4
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Formula:
C25H22ClN3O3S
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Chemical Name:
2-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl]sulfanyl-3-benzyl-7-chloroquinazolin-4-one
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Synonyms:
ZINC3336117;AKOS033910606;MCULE-3437420725;Z24348512;2-{[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl]sulfanyl}-3-benzyl-7-chloro-3,4-dihydroquinazolin-4-one;796054-49-4
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CAS No:
2-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl]sulfanyl-3-benzyl-7-chloroquinazolin-4-one Basic Attributes
480.0 g/mol
479.1070404 g/mol
Computed Properties
Molecular Weight:480.0
XLogP3:4.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:479.1070404
Monoisotopic Mass:479.1070404
Topological Polar Surface Area:108
Heavy Atom Count:33
Complexity:800
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 2-[2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl]sulfanyl-3-benzyl-7-chloroquinazolin-4-one
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