2-[4-(4-methoxyphenyl)-3,5-dioxo-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7)-dien-6-yl]acetamide
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![2-[4-(4-methoxyphenyl)-3,5-dioxo-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7)-dien-6-yl]acetamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/9151f1240213441690afef4e91d13346.png "2-[4-(4-methoxyphenyl)-3,5-dioxo-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7)-dien-6-yl]acetamide")
2-[4-(4-methoxyphenyl)-3,5-dioxo-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7)-dien-6-yl]acetamide
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CAS No:
896827-97-7
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Formula:
C20H21N3O4S
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Chemical Name:
2-[4-(4-methoxyphenyl)-3,5-dioxo-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7)-dien-6-yl]acetamide
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Synonyms:
MLS000763203;SMR000439903;2-[3-(4-Methoxy-phenyl)-2,4-dioxo-3,4,6,7,8,9-hexahydro-2H,5H-10-thia-1,3-diaza-benzo[a]azulen-1-yl]- acetamide;CHEMBL1393144;BDBM72722;cid_1850135;HMS2793O22;ZINC2217511;STK594678;AKOS005516319;MCULE-4979820654;2-[2,4-diketo-3-(4-methoxyphenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[2,3]thieno[2,4-b]pyrimidin-1-yl]acetamide;2-[3-(4-methoxyphenyl)-2,4-bis(oxidanylidene)-6,7,8,9-tetrahydro-5H-cyclohepta[2,3]thieno[2,4-b]pyrimidin-1-yl]ethanamide;2-[3-(4-methoxyphenyl)-2,4-dioxo-3,4,6,7,8,9-hexahydro-2H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-1(5H)-yl]acetamide;2-[3-(4-methoxyphenyl)-2,4-dioxo-6,7,8,9-tetrahydro-5H-cyclohepta[2,3]thieno[2,4-b]pyrimidin-1-yl]acetamide;896827-97-7
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CAS No:
2-[4-(4-methoxyphenyl)-3,5-dioxo-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7)-dien-6-yl]acetamide Basic Attributes
399.5 g/mol
399.12527733 g/mol
Computed Properties
Molecular Weight:399.5
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:399.12527733
Monoisotopic Mass:399.12527733
Topological Polar Surface Area:121
Heavy Atom Count:28
Complexity:637
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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