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3-[3-(4-bromophenyl)-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]pyrazol-1-yl]propanenitrile
3-[3-(4-bromophenyl)-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]pyrazol-1-yl]propanenitrile
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![3-[3-(4-bromophenyl)-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]pyrazol-1-yl]propanenitrile structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/1a85078c28ba4b05934e98cd2fa34842.png "3-[3-(4-bromophenyl)-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]pyrazol-1-yl]propanenitrile")
3-[3-(4-bromophenyl)-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]pyrazol-1-yl]propanenitrile
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CAS No:
372098-47-0
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Formula:
C17H12BrN5O3
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Chemical Name:
3-[3-(4-bromophenyl)-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]pyrazol-1-yl]propanenitrile
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Synonyms:
ZINC3188083;AKOS034476369;MCULE-3680251795;SR-01000028747;SR-01000028747-1;Z57993198;3-[3-(4-bromophenyl)-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-1H-pyrazol-1-yl]propanenitrile;372098-47-0
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CAS No:
3-[3-(4-bromophenyl)-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]pyrazol-1-yl]propanenitrile Basic Attributes
414.2 g/mol
413.01235 g/mol
Computed Properties
Molecular Weight:414.2
XLogP3:1.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:413.01235
Monoisotopic Mass:413.01235
Topological Polar Surface Area:117
Heavy Atom Count:26
Complexity:655
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 3-[3-(4-bromophenyl)-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]pyrazol-1-yl]propanenitrile
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