4-(4-fluorophenyl)-5-(2-methoxyethylamino)-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one
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![4-(4-fluorophenyl)-5-(2-methoxyethylamino)-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/c9f53f7947a44ca19377a68d98ee88fb.png "4-(4-fluorophenyl)-5-(2-methoxyethylamino)-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one")
4-(4-fluorophenyl)-5-(2-methoxyethylamino)-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one
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CAS No:
899393-42-1
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Formula:
C20H22FN3O2S
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Chemical Name:
4-(4-fluorophenyl)-5-(2-methoxyethylamino)-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one
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Synonyms:
ZINC2324529;STK578035;AKOS005502076;MCULE-1919114188;3-(4-fluorophenyl)-2-[(2-methoxyethyl)amino]-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one;899393-42-1
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CAS No:
4-(4-fluorophenyl)-5-(2-methoxyethylamino)-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one Basic Attributes
387.5 g/mol
387.14167629 g/mol
Computed Properties
Molecular Weight:387.5
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:387.14167629
Monoisotopic Mass:387.14167629
Topological Polar Surface Area:82.2
Heavy Atom Count:27
Complexity:567
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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