2-[2-[[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]carbamoyl]phenyl]benzoic acid
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![2-[2-[[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]carbamoyl]phenyl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/7aa0f19c26df4ba88bac284de41febb9.png "2-[2-[[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]carbamoyl]phenyl]benzoic acid")
2-[2-[[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]carbamoyl]phenyl]benzoic acid
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CAS No:
725219-78-3
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Formula:
C22H14N4O5S
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Chemical Name:
2-[2-[[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]carbamoyl]phenyl]benzoic acid
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Synonyms:
ZINC2235297;STK610748;AKOS005545868;AKOS030520918;MCULE-5189350705;2'-{[(2Z)-5-(3-nitrophenyl)-1,3,4-thiadiazol-2(3H)-ylidene]carbamoyl}biphenyl-2-carboxylic acid;725219-78-3
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CAS No:
2-[2-[[5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]carbamoyl]phenyl]benzoic acid Basic Attributes
446.4 g/mol
446.06849073 g/mol
Computed Properties
Molecular Weight:446.4
XLogP3:4.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:446.06849073
Monoisotopic Mass:446.06849073
Topological Polar Surface Area:166
Heavy Atom Count:32
Complexity:704
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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