2-(4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[d][1,3]thiazol-2-ylcarbamoyl)benzoic acid
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![2-(4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[d][1,3]thiazol-2-ylcarbamoyl)benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/0b7451e8c7da495cb77acc5c5d34a05a.png "2-(4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[d][1,3]thiazol-2-ylcarbamoyl)benzoic acid")
2-(4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[d][1,3]thiazol-2-ylcarbamoyl)benzoic acid
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CAS No:
714927-53-4
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Formula:
C21H26N2O3S
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Chemical Name:
2-(4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[d][1,3]thiazol-2-ylcarbamoyl)benzoic acid
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Synonyms:
ZINC1889371;STL050951;AKOS005704183;AKOS032389300;MCULE-3975792401;2-[(2Z)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[d][1,3]thiazol-2(3H)-ylidenecarbamoyl]benzoic acid;714927-53-4
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CAS No:
2-(4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[d][1,3]thiazol-2-ylcarbamoyl)benzoic acid Basic Attributes
386.5 g/mol
386.16641387 g/mol
Computed Properties
Molecular Weight:386.5
XLogP3:6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:386.16641387
Monoisotopic Mass:386.16641387
Topological Polar Surface Area:108
Heavy Atom Count:27
Complexity:502
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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