N-(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)-N',N'-diethylpropane-1,3-diamine
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![N-(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)-N',N'-diethylpropane-1,3-diamine structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/da19c495f36049968281f486011f4f73.png "N-(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)-N',N'-diethylpropane-1,3-diamine")
N-(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)-N',N'-diethylpropane-1,3-diamine
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CAS No:
847380-51-2
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Formula:
C21H34N4OS2
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Chemical Name:
N-(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)-N',N'-diethylpropane-1,3-diamine
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Synonyms:
ZINC2333087;STL564303;AKOS032389105;MCULE-8747927132;847380-51-2;N'-[6,6-dimethyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]-N,N-diethylpropane-1,3-diamine
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CAS No:
N-(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)-N',N'-diethylpropane-1,3-diamine Basic Attributes
422.7 g/mol
422.21740407 g/mol
Computed Properties
Molecular Weight:422.7
XLogP3:5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:422.21740407
Monoisotopic Mass:422.21740407
Topological Polar Surface Area:104
Heavy Atom Count:28
Complexity:489
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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