3-Thiazolidineacetic acid, 5-[[3-[4-(hexyloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-4-oxo-2-thioxo-
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![3-Thiazolidineacetic acid, 5-[[3-[4-(hexyloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-4-oxo-2-thioxo- structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/1982d99e9cc5461e81226473146dce45.png "3-Thiazolidineacetic acid, 5-[[3-[4-(hexyloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-4-oxo-2-thioxo-")
3-Thiazolidineacetic acid, 5-[[3-[4-(hexyloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-4-oxo-2-thioxo-
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CAS No:
955893-04-6
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Formula:
C27H27N3O4S2
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Chemical Name:
3-Thiazolidineacetic acid, 5-[[3-[4-(hexyloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-4-oxo-2-thioxo-
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Synonyms:
[5-([3-[4-(HEXYLOXY)PHENYL]-1-PHENYL-1H-PYRAZOL-4-YL]METHYLENE)-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-3-YL]ACETIC ACID;
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CAS No:
3-Thiazolidineacetic acid, 5-[[3-[4-(hexyloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-4-oxo-2-thioxo- Basic Attributes
521.65100
521.14429870
Safety Information
H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]|P273, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:521.7
XLogP3:6.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:11
Exact Mass:521.14429870
Monoisotopic Mass:521.14429870
Topological Polar Surface Area:142
Heavy Atom Count:36
Complexity:809
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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