[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-4-oxochromen-7-yl] (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate
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![[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-4-oxochromen-7-yl] (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/cb7d3e99cda24200a83d18affe2a62a2.png "[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-4-oxochromen-7-yl] (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate")
[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-4-oxochromen-7-yl] (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate
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CAS No:
262428-33-1
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Formula:
C28H31NO8S
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Chemical Name:
[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-4-oxochromen-7-yl] (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate
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Synonyms:
C28H31NO8S;ZINC2090715;STK921325;AKOS016357591;MCULE-9302221564;262428-33-1;3-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)-2-METHYL-4-OXO-4H-CHROMEN-7-YL (2S)-2-[(TERT-BUTOXYCARBONYL)AMINO]-4-(METHYLSULFANYL)BUTANOATE;3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-4-oxo-4H-chromen-7-yl N-(tert-butoxycarbonyl)-L-methioninate
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CAS No:
[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-4-oxochromen-7-yl] (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate Basic Attributes
541.6 g/mol
541.17703812 g/mol
Computed Properties
Molecular Weight:541.6
XLogP3:4.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:10
Exact Mass:541.17703812
Monoisotopic Mass:541.17703812
Topological Polar Surface Area:135
Heavy Atom Count:38
Complexity:915
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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