N',N'-dimethyl-N-[7-(2-methylpropyl)-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl]propane-1,3-diamine
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![N',N'-dimethyl-N-[7-(2-methylpropyl)-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl]propane-1,3-diamine structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/5ad6977876b8480dacfb719fb6f8db96.png "N',N'-dimethyl-N-[7-(2-methylpropyl)-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl]propane-1,3-diamine")
N',N'-dimethyl-N-[7-(2-methylpropyl)-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl]propane-1,3-diamine
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CAS No:
799810-68-7
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Formula:
C21H29N5S
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Chemical Name:
N',N'-dimethyl-N-[7-(2-methylpropyl)-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl]propane-1,3-diamine
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Synonyms:
ZINC2232014;STK721537;AKOS005530130;MCULE-4270645888;799810-68-7;N,N-dimethyl-N'-[4-(2-methylpropyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl]propane-1,3-diamine
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CAS No:
N',N'-dimethyl-N-[7-(2-methylpropyl)-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl]propane-1,3-diamine Basic Attributes
383.6 g/mol
383.21436712 g/mol
Computed Properties
Molecular Weight:383.6
XLogP3:5.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:383.21436712
Monoisotopic Mass:383.21436712
Topological Polar Surface Area:82.2
Heavy Atom Count:27
Complexity:487
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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