2-[[4-(4-bromophenyl)-3-ethoxycarbonylthiophen-2-yl]carbamoyl]benzoic acid
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![2-[[4-(4-bromophenyl)-3-ethoxycarbonylthiophen-2-yl]carbamoyl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/db08ac3a57e54e388df2f814ab31bd05.png "2-[[4-(4-bromophenyl)-3-ethoxycarbonylthiophen-2-yl]carbamoyl]benzoic acid")
2-[[4-(4-bromophenyl)-3-ethoxycarbonylthiophen-2-yl]carbamoyl]benzoic acid
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CAS No:
312939-81-4
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Formula:
C21H16BrNO5S
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Chemical Name:
2-[[4-(4-bromophenyl)-3-ethoxycarbonylthiophen-2-yl]carbamoyl]benzoic acid
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Synonyms:
C21H16BrNO5S;CHEMBL603471;ZINC2812041;STK744709;AKOS005527720;MCULE-7959057843;EU-0038813;SR-01000438477;SR-01000438477-1;2-{[4-(4-bromophenyl)-3-(ethoxycarbonyl)thiophen-2-yl]carbamoyl}benzoic acid;312939-81-4
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CAS No:
2-[[4-(4-bromophenyl)-3-ethoxycarbonylthiophen-2-yl]carbamoyl]benzoic acid Basic Attributes
474.3 g/mol
472.99326 g/mol
Computed Properties
Molecular Weight:474.3
XLogP3:5.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:472.99326
Monoisotopic Mass:472.99326
Topological Polar Surface Area:121
Heavy Atom Count:29
Complexity:610
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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