(7-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-9-yl) (2S,3R)-3-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate
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![(7-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-9-yl) (2S,3R)-3-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/bbd9b56009bd4c9380f11896074f4a24.png "(7-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-9-yl) (2S,3R)-3-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate")
(7-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-9-yl) (2S,3R)-3-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate
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CAS No:
1173666-66-4
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Formula:
C26H29NO6S
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Chemical Name:
(7-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-9-yl) (2S,3R)-3-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate
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Synonyms:
ZINC2148746;STL462446;AKOS016362607;MCULE-7003152416;(2S,3R)-7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-yl 3-methyl-2-(4-methylphenylsulfonamido)pentanoate;1173666-66-4;7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-yl (2S,3R)-3-methyl-2-{[(4-methylphenyl)sulfonyl]amino}pentanoate;7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-yl N-[(4-methylphenyl)sulfonyl]-L-isoleucinate
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CAS No:
(7-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-9-yl) (2S,3R)-3-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate Basic Attributes
483.6 g/mol
483.17155882 g/mol
Computed Properties
Molecular Weight:483.6
XLogP3:5.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:483.17155882
Monoisotopic Mass:483.17155882
Topological Polar Surface Area:107
Heavy Atom Count:34
Complexity:914
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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