N-[2-(3,4-dimethoxyphenyl)ethyl]-8-(furan-2-yl)-4,4-dimethyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-amine
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![N-[2-(3,4-dimethoxyphenyl)ethyl]-8-(furan-2-yl)-4,4-dimethyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-amine structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/2049feae2b4e4b86adc783de370532ab.png "N-[2-(3,4-dimethoxyphenyl)ethyl]-8-(furan-2-yl)-4,4-dimethyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-amine")
N-[2-(3,4-dimethoxyphenyl)ethyl]-8-(furan-2-yl)-4,4-dimethyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-amine
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CAS No:
844447-51-4
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Formula:
C28H28N4O4S
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Chemical Name:
N-[2-(3,4-dimethoxyphenyl)ethyl]-8-(furan-2-yl)-4,4-dimethyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-amine
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Synonyms:
ZINC2400942;STL304543;AKOS022116852;MCULE-4548921844;844447-51-4;N-[2-(3,4-dimethoxyphenyl)ethyl]-5-(furan-2-yl)-2,2-dimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine
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CAS No:
N-[2-(3,4-dimethoxyphenyl)ethyl]-8-(furan-2-yl)-4,4-dimethyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-amine Basic Attributes
516.6 g/mol
516.18312656 g/mol
Computed Properties
Molecular Weight:516.6
XLogP3:5.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:7
Exact Mass:516.18312656
Monoisotopic Mass:516.18312656
Topological Polar Surface Area:120
Heavy Atom Count:37
Complexity:777
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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