N-[2-(3,4-dimethoxyphenyl)ethyl]-4,4,8-trimethyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12(17),13,15-hexaen-13-amine
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![N-[2-(3,4-dimethoxyphenyl)ethyl]-4,4,8-trimethyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12(17),13,15-hexaen-13-amine structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/eca33d3b53a14ac6aaef81b685074282.png "N-[2-(3,4-dimethoxyphenyl)ethyl]-4,4,8-trimethyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12(17),13,15-hexaen-13-amine")
N-[2-(3,4-dimethoxyphenyl)ethyl]-4,4,8-trimethyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12(17),13,15-hexaen-13-amine
structure -
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CAS No:
845982-94-7
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Formula:
C25H28N4O3S
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Chemical Name:
N-[2-(3,4-dimethoxyphenyl)ethyl]-4,4,8-trimethyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12(17),13,15-hexaen-13-amine
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Synonyms:
ZINC2418718;STL304490;AKOS022125088;MCULE-5412494149;845982-94-7;N-[2-(3,4-dimethoxyphenyl)ethyl]-2,2,5-trimethyl-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]-4,4,8-trimethyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12(17),13,15-hexaen-13-amine Basic Attributes
464.6 g/mol
464.18821194 g/mol
Computed Properties
Molecular Weight:464.6
XLogP3:4.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:464.18821194
Monoisotopic Mass:464.18821194
Topological Polar Surface Area:107
Heavy Atom Count:33
Complexity:670
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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