N-[2-(METHYLTHIO)NICOTINOYL]-L-LEUCINE
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![N-[2-(METHYLTHIO)NICOTINOYL]-L-LEUCINE structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/cdd13d9459514dc2ac6b53bc0e1abc68.png "N-[2-(METHYLTHIO)NICOTINOYL]-L-LEUCINE")
N-[2-(METHYLTHIO)NICOTINOYL]-L-LEUCINE
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CAS No:
175201-69-1
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Formula:
C13H18N2O3S
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Chemical Name:
N-[2-(METHYLTHIO)NICOTINOYL]-L-LEUCINE
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Synonyms:
4-Methyl-2-({[2-(methylthio)pyridin-3-yl]carbonyl}amino)pentanoic acid;N-[2-(METHYLTHIO)NICOTINOYL]-L-LEUCINE;4-METHYL-2-([[2-(METHYLTHIO)-3-PYRIDYL]CARBONYL]AMINO)PENTANOIC ACID;4-Methyl-2-({[2-(methylthio)pyridin-3-yl]carbonyl}amino)pent;L-Leucine, N-[[2-(methylthio)-3-pyridinyl]carbonyl]-;(S)-4-Methyl-2-(2-(methylthio)nicotinamido)pentanoic Acid
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CAS No:
N-[2-(METHYLTHIO)NICOTINOYL]-L-LEUCINE Basic Attributes
282.36
282.10381361
DTXSID80381001
2933399090
Characteristics
104.59000
2.42350
1.23±0.1 g/cm3
506.2±45.0 °C(Predicted)
259.9ºC
1.57
4.55E-11mmHg at 25°C
3.31±0.21
Computed Properties
Molecular Weight:282.36
XLogP3:2.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:282.10381361
Monoisotopic Mass:282.10381361
Topological Polar Surface Area:105
Heavy Atom Count:19
Complexity:323
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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