6-[2-[(3,4-dimethoxyphenyl)methylideneamino]phenyl]-3-sulfanylidene-2H-1,2,4-triazin-5-one
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![6-[2-[(3,4-dimethoxyphenyl)methylideneamino]phenyl]-3-sulfanylidene-2H-1,2,4-triazin-5-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/b7116480e2a34b5abfdcb807b72a04ce.png "6-[2-[(3,4-dimethoxyphenyl)methylideneamino]phenyl]-3-sulfanylidene-2H-1,2,4-triazin-5-one")
6-[2-[(3,4-dimethoxyphenyl)methylideneamino]phenyl]-3-sulfanylidene-2H-1,2,4-triazin-5-one
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CAS No:
303095-20-7
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Formula:
C18H16N4O3S
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Chemical Name:
6-[2-[(3,4-dimethoxyphenyl)methylideneamino]phenyl]-3-sulfanylidene-2H-1,2,4-triazin-5-one
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Synonyms:
Oprea1_523147;ZINC3189764;ZINC03189765;AKOS003622822;MCULE-6379673229;6-(2-((3,4-DIMETHOXYBENZYLIDENE)AMINO)PH)-5-HYDROXY-1,2,4-TRIAZINE-3(4H)-THIONE;303095-20-7;6-(2-((3,4-Dimethoxybenzylidene)amino)phenyl)-3-thioxo-3,4-dihydro-1,2,4-triazin-5(2H)-one
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CAS No:
6-[2-[(3,4-dimethoxyphenyl)methylideneamino]phenyl]-3-sulfanylidene-2H-1,2,4-triazin-5-one Basic Attributes
368.4 g/mol
368.09431156 g/mol
Safety Information
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:368.4
XLogP3:2.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:368.09431156
Monoisotopic Mass:368.09431156
Topological Polar Surface Area:116
Heavy Atom Count:26
Complexity:595
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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