2-[2-[(12,12-dimethyl-5-propan-2-ylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)amino]ethoxy]ethanol
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2-[2-[(12,12-dimethyl-5-propan-2-ylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)amino]ethoxy]ethanol
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CAS No:
844852-04-6
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Formula:
C18H27N3O3S2
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Chemical Name:
2-[2-[(12,12-dimethyl-5-propan-2-ylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)amino]ethoxy]ethanol
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Synonyms:
ZINC2410987;STL343304;AKOS022100092;MCULE-3740424753;2-(2-{[6,6-dimethyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]amino}ethoxy)ethanol;844852-04-6
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CAS No:
2-[2-[(12,12-dimethyl-5-propan-2-ylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)amino]ethoxy]ethanol Basic Attributes
397.6 g/mol
397.14938408 g/mol
Computed Properties
Molecular Weight:397.6
XLogP3:3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:8
Exact Mass:397.14938408
Monoisotopic Mass:397.14938408
Topological Polar Surface Area:130
Heavy Atom Count:26
Complexity:455
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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