5-amino-N-(3-ethoxyphenyl)-7-thia-1,9-diazatetracyclo[9.2.2.0~2,10~.0~4,8~]pentadeca-2(10),3,5,8-tetraene-6-carboxamide
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![5-amino-N-(3-ethoxyphenyl)-7-thia-1,9-diazatetracyclo[9.2.2.0~2,10~.0~4,8~]pentadeca-2(10),3,5,8-tetraene-6-carboxamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/005cbb9e026342af9396806c91c04c98.png "5-amino-N-(3-ethoxyphenyl)-7-thia-1,9-diazatetracyclo[9.2.2.0~2,10~.0~4,8~]pentadeca-2(10),3,5,8-tetraene-6-carboxamide")
5-amino-N-(3-ethoxyphenyl)-7-thia-1,9-diazatetracyclo[9.2.2.0~2,10~.0~4,8~]pentadeca-2(10),3,5,8-tetraene-6-carboxamide
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CAS No:
923552-64-1
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Formula:
C21H22N4O2S
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Chemical Name:
5-amino-N-(3-ethoxyphenyl)-7-thia-1,9-diazatetracyclo[9.2.2.0~2,10~.0~4,8~]pentadeca-2(10),3,5,8-tetraene-6-carboxamide
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Synonyms:
5-amino-N-(3-ethoxyphenyl)-7-thia-1,9-diazatetracyclo[9.2.2.0^{2,10}.0^{4,8}]pentadeca-2,4(8),5,9-tetraene-6-carboxamide;AM-807/43303213;KS-00003RNJ;ZINC8763212;RSC003146;AKOS004112888;MCULE-8803310549;SS-0116;5-amino-N-(3-ethoxyphenyl)-7-thia-1,9-diazatetracyclo[9.2.2.0~2,10~.0~4,8~]pentadeca-2(10),3,5,8-tetraene-6-carboxamide;5-amino-N-(3-ethoxyphenyl)-7-thia-1,9-diazatetracyclo[9.2.2.0~2,10~.0~4,8~]pentadeca-2,4(8),5,9-tetraene-6-carboxamide
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CAS No:
5-amino-N-(3-ethoxyphenyl)-7-thia-1,9-diazatetracyclo[9.2.2.0~2,10~.0~4,8~]pentadeca-2(10),3,5,8-tetraene-6-carboxamide Basic Attributes
394.48998
394.146
Computed Properties
Molecular Weight:394.5
XLogP3:4.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:394.14634713
Monoisotopic Mass:394.14634713
Topological Polar Surface Area:109
Heavy Atom Count:28
Complexity:585
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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