N-[5-(3,5-dimethylpyrazol-1-yl)-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl]-N',N'-diethylethane-1,2-diamine
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![N-[5-(3,5-dimethylpyrazol-1-yl)-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl]-N',N'-diethylethane-1,2-diamine structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/940538a850024b69b1dd52c3d3e211e6.png "N-[5-(3,5-dimethylpyrazol-1-yl)-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl]-N',N'-diethylethane-1,2-diamine")
N-[5-(3,5-dimethylpyrazol-1-yl)-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl]-N',N'-diethylethane-1,2-diamine
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CAS No:
850827-50-8
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Formula:
C22H32N6OS
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Chemical Name:
N-[5-(3,5-dimethylpyrazol-1-yl)-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl]-N',N'-diethylethane-1,2-diamine
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Synonyms:
MLS000762507;CHEMBL1565693;HMS2799M22;ZINC2419389;STL236037;AKOS025275611;MCULE-8270823588;SMR000438103;850827-50-8;N'-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]-N,N-diethylethane-1,2-diamine;N'-[2-(3,5-Dimethyl-pyrazol-1-yl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-y l]-N,N-diethyl-ethane-1,2-diamine
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CAS No:
N-[5-(3,5-dimethylpyrazol-1-yl)-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl]-N',N'-diethylethane-1,2-diamine Basic Attributes
428.6 g/mol
428.23583084 g/mol
Computed Properties
Molecular Weight:428.6
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:428.23583084
Monoisotopic Mass:428.23583084
Topological Polar Surface Area:96.3
Heavy Atom Count:30
Complexity:576
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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