(4-ethyl-8-methyl-2-oxochromen-7-yl) (2S,3R)-3-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate
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![(4-ethyl-8-methyl-2-oxochromen-7-yl) (2S,3R)-3-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/903ba33ad5794b1a8861c3947f7a1ed5.png "(4-ethyl-8-methyl-2-oxochromen-7-yl) (2S,3R)-3-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate")
(4-ethyl-8-methyl-2-oxochromen-7-yl) (2S,3R)-3-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate
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CAS No:
1173687-01-8
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Formula:
C25H29NO6S
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Chemical Name:
(4-ethyl-8-methyl-2-oxochromen-7-yl) (2S,3R)-3-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate
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Synonyms:
ZINC2092027;STL531397;AKOS037496019;4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-isoleucinate;(2S,3R)-4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl 3-methyl-2-(4-methylphenylsulfonamido)pentanoate;1173687-01-8
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CAS No:
(4-ethyl-8-methyl-2-oxochromen-7-yl) (2S,3R)-3-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate Basic Attributes
471.6 g/mol
471.17155882 g/mol
Computed Properties
Molecular Weight:471.6
XLogP3:5.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:471.17155882
Monoisotopic Mass:471.17155882
Topological Polar Surface Area:107
Heavy Atom Count:33
Complexity:839
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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