2-[(2-cyanophenyl)methylsulfanyl]pyridine-3-carboxylic acid
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![2-[(2-cyanophenyl)methylsulfanyl]pyridine-3-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/29117f8c259a4f9eb4ec66ce63a6225c.png "2-[(2-cyanophenyl)methylsulfanyl]pyridine-3-carboxylic acid")
2-[(2-cyanophenyl)methylsulfanyl]pyridine-3-carboxylic acid
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CAS No:
750618-84-9
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Formula:
C14H10N2O2S
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Chemical Name:
2-[(2-cyanophenyl)methylsulfanyl]pyridine-3-carboxylic acid
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Synonyms:
MLS001171124;CHEMBL2139556;HMS1723O06;HMS2914F21;ZINC3268789;2-{[(2-CYANOPHENYL)METHYL]SULFANYL}PYRIDINE-3-CARBOXYLIC ACID;AKOS000154345;MCULE-6487770215;SMR000592638;SR-01000035836;SR-01000035836-1;Z56854690;750618-84-9
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CAS No:
2-[(2-cyanophenyl)methylsulfanyl]pyridine-3-carboxylic acid Basic Attributes
270.31 g/mol
270.04629874 g/mol
Computed Properties
Molecular Weight:270.31
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:270.04629874
Monoisotopic Mass:270.04629874
Topological Polar Surface Area:99.3
Heavy Atom Count:19
Complexity:366
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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