2-[[5-(4-ethylanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid
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![2-[[5-(4-ethylanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/4a257e2114274650bbaf9d9f9257b1d6.png "2-[[5-(4-ethylanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid")
2-[[5-(4-ethylanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid
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CAS No:
796084-05-4
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Formula:
C19H17N5O3S3
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Chemical Name:
2-[[5-(4-ethylanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid
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Synonyms:
ZINC3342522;AKOS033940051;MCULE-6914006858;Z25378762;2-[({5-[(4-ethylphenyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)methyl]-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxylic acid;796084-05-4
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CAS No:
2-[[5-(4-ethylanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid Basic Attributes
459.6 g/mol
459.04935294 g/mol
Computed Properties
Molecular Weight:459.6
XLogP3:4.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:7
Exact Mass:459.04935294
Monoisotopic Mass:459.04935294
Topological Polar Surface Area:198
Heavy Atom Count:30
Complexity:688
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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