methyl 2-[[13,13-dimethyl-6-(3-methylphenyl)-7-oxo-12-oxa-2,4,6-triazatricyclo[8.4.0.03,8]tetradeca-1,3(8),4,9-tetraen-5-yl]sulfanyl]acetate
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methyl 2-[[13,13-dimethyl-6-(3-methylphenyl)-7-oxo-12-oxa-2,4,6-triazatricyclo[8.4.0.03,8]tetradeca-1,3(8),4,9-tetraen-5-yl]sulfanyl]acetate
structure -
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CAS No:
371206-60-9
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Formula:
C22H23N3O4S
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Chemical Name:
methyl 2-[[13,13-dimethyl-6-(3-methylphenyl)-7-oxo-12-oxa-2,4,6-triazatricyclo[8.4.0.03,8]tetradeca-1,3(8),4,9-tetraen-5-yl]sulfanyl]acetate
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Synonyms:
ZINC2315473;STL332736;AKOS022126986;MCULE-7732246163;371206-60-9;methyl {[8,8-dimethyl-3-(3-methylphenyl)-4-oxo-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
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CAS No:
methyl 2-[[13,13-dimethyl-6-(3-methylphenyl)-7-oxo-12-oxa-2,4,6-triazatricyclo[8.4.0.03,8]tetradeca-1,3(8),4,9-tetraen-5-yl]sulfanyl]acetate Basic Attributes
425.5 g/mol
425.14092740 g/mol
Computed Properties
Molecular Weight:425.5
XLogP3:3.3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:425.14092740
Monoisotopic Mass:425.14092740
Topological Polar Surface Area:106
Heavy Atom Count:30
Complexity:713
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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