methyl 2-[(4-bromophenyl)sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate
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![methyl 2-[(4-bromophenyl)sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/ece9babe385a4925a194f5c9fdb75373.png "methyl 2-[(4-bromophenyl)sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate")
methyl 2-[(4-bromophenyl)sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate
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CAS No:
736163-24-9
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Formula:
C16H13BrN2O3S2
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Chemical Name:
methyl 2-[(4-bromophenyl)sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate
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Synonyms:
MLS000773333;SMR000364037;CHEMBL1350703;BDBM88939;cid_2442831;HMS2773A09;ZINC13637213;AKOS034385569;MCULE-9859223924;methyl 2-[(4-bromophenyl)sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate;Z46215300;2-[[(4-bromophenyl)thio]methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester;2-[[(4-bromophenyl)thio]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester;736163-24-9;methyl 2-[(4-bromophenyl)sulfanylmethyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate;methyl 2-{[(4-bromophenyl)sulfanyl]methyl}-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxylate
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CAS No:
methyl 2-[(4-bromophenyl)sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Basic Attributes
425.3 g/mol
423.95510 g/mol
Computed Properties
Molecular Weight:425.3
XLogP3:4.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:423.95510
Monoisotopic Mass:423.95510
Topological Polar Surface Area:121
Heavy Atom Count:24
Complexity:537
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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