2-[[6-(4-methoxyphenyl)-13,13-dimethyl-7-oxo-12-oxa-2,4,6-triazatricyclo[8.4.0.03,8]tetradeca-1,3(8),4,9-tetraen-5-yl]sulfanyl]acetamide
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![2-[[6-(4-methoxyphenyl)-13,13-dimethyl-7-oxo-12-oxa-2,4,6-triazatricyclo[8.4.0.03,8]tetradeca-1,3(8),4,9-tetraen-5-yl]sulfanyl]acetamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/5880c6c7712d4ef18b1f5c3dd32e1041.png "2-[[6-(4-methoxyphenyl)-13,13-dimethyl-7-oxo-12-oxa-2,4,6-triazatricyclo[8.4.0.03,8]tetradeca-1,3(8),4,9-tetraen-5-yl]sulfanyl]acetamide")
2-[[6-(4-methoxyphenyl)-13,13-dimethyl-7-oxo-12-oxa-2,4,6-triazatricyclo[8.4.0.03,8]tetradeca-1,3(8),4,9-tetraen-5-yl]sulfanyl]acetamide
structure -
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CAS No:
372185-11-0
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Formula:
C21H22N4O4S
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Chemical Name:
2-[[6-(4-methoxyphenyl)-13,13-dimethyl-7-oxo-12-oxa-2,4,6-triazatricyclo[8.4.0.03,8]tetradeca-1,3(8),4,9-tetraen-5-yl]sulfanyl]acetamide
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Synonyms:
MLS000552561;Oprea1_322673;CHEMBL1329333;ZINC2276120;STK524455;AKOS005458665;MCULE-1403182138;SMR000146076;2-[3-(4-Methoxy-phenyl)-7,7-dimethyl-4-oxo-3,5,7,8-tetrahydro-4H-6-oxa-1,3,9-triaza-anthracen-2-ylsulf anyl]-acetamide;2-{[3-(4-methoxyphenyl)-8,8-dimethyl-4-oxo-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide;372185-11-0
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CAS No:
2-[[6-(4-methoxyphenyl)-13,13-dimethyl-7-oxo-12-oxa-2,4,6-triazatricyclo[8.4.0.03,8]tetradeca-1,3(8),4,9-tetraen-5-yl]sulfanyl]acetamide Basic Attributes
426.5 g/mol
426.13617637 g/mol
Computed Properties
Molecular Weight:426.5
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:426.13617637
Monoisotopic Mass:426.13617637
Topological Polar Surface Area:132
Heavy Atom Count:30
Complexity:707
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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