2-[[[(3-BROMO-4-METHOXYBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
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![2-[[[(3-BROMO-4-METHOXYBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/8edd688f444a40148a3dae5f71494fee.png "2-[[[(3-BROMO-4-METHOXYBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID")
2-[[[(3-BROMO-4-METHOXYBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
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CAS No:
433970-69-5
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Formula:
C16H13BrN2O4S
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Chemical Name:
2-[[[(3-BROMO-4-METHOXYBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
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Synonyms:
CTK8I7388;ZINC1158533;STK017319;AKOS000289150;MCULE-5552675552;2-(3-(3-bromo-4-methoxybenzoyl)thioureido)benzoic acid;2-({[(3-bromo-4-methoxyphenyl)carbonyl]carbamothioyl}amino)benzoic acid
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CAS No:
2-[[[(3-BROMO-4-METHOXYBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID Basic Attributes
409.254
407.978
Computed Properties
Molecular Weight:409.3
XLogP3:3.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:407.97794
Monoisotopic Mass:407.97794
Topological Polar Surface Area:120
Heavy Atom Count:24
Complexity:491
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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