(2S)-5-(carbamoylamino)-2-[3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoylamino]pentanoic acid
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![(2S)-5-(carbamoylamino)-2-[3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoylamino]pentanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/81c4738f917149279ec00e07bbb0b81c.png "(2S)-5-(carbamoylamino)-2-[3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoylamino]pentanoic acid")
(2S)-5-(carbamoylamino)-2-[3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoylamino]pentanoic acid
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CAS No:
956045-56-0
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Formula:
C26H31N3O7
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Chemical Name:
(2S)-5-(carbamoylamino)-2-[3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoylamino]pentanoic acid
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Synonyms:
ZINC2102257;EiM07-29174;AKOS030499133;MCULE-6914043451;956045-56-0
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CAS No:
(2S)-5-(carbamoylamino)-2-[3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoylamino]pentanoic acid Basic Attributes
497.5 g/mol
497.21620034 g/mol
Computed Properties
Molecular Weight:497.5
XLogP3:2.4
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:497.21620034
Monoisotopic Mass:497.21620034
Topological Polar Surface Area:161
Heavy Atom Count:36
Complexity:919
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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