N',N'-dimethyl-N-[7-(2-methylpropyl)-14-methylsulfanyl-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)-14-methylsulfanyl-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/20220812/371fe90391ed41678f67804c439463bf.png "N',N'-dimethyl-N-[7-(2-methylpropyl)-14-methylsulfanyl-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)-14-methylsulfanyl-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:
573706-94-2
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Formula:
C22H31N5S2
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Chemical Name:
N',N'-dimethyl-N-[7-(2-methylpropyl)-14-methylsulfanyl-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:
ZINC2445472;STK721751;AKOS005530403;MCULE-2613652268;573706-94-2;N,N-dimethyl-N'-[4-(2-methylpropyl)-9-(methylsulfanyl)-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)-14-methylsulfanyl-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
429.6 g/mol
429.20208836 g/mol
Computed Properties
Molecular Weight:429.6
XLogP3:5.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:429.20208836
Monoisotopic Mass:429.20208836
Topological Polar Surface Area:108
Heavy Atom Count:29
Complexity:533
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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