6-[2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-4H-1,4-benzoxazin-3-one
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![6-[2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-4H-1,4-benzoxazin-3-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/4dca5fb1f21e408dba88a6457a0de4a9.png "6-[2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-4H-1,4-benzoxazin-3-one")
6-[2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-4H-1,4-benzoxazin-3-one
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CAS No:
756848-61-0
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Formula:
C21H24N4O3S
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Chemical Name:
6-[2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-4H-1,4-benzoxazin-3-one
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Synonyms:
ZINC02664097;ZINC2664097;AKOS000827893;MCULE-1014968122;SR-01000054619;SR-01000054619-1;Z15820582;6-(2-{[5-cyclohexyl-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)-3,4-dihydro-2H-1,4-benzoxazin-3-one;756848-61-0
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CAS No:
6-[2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-4H-1,4-benzoxazin-3-one Basic Attributes
412.5 g/mol
412.15691181 g/mol
Computed Properties
Molecular Weight:412.5
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:412.15691181
Monoisotopic Mass:412.15691181
Topological Polar Surface Area:111
Heavy Atom Count:29
Complexity:613
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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