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4-benzyl-5-(3-hydroxypropylamino)-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one
4-benzyl-5-(3-hydroxypropylamino)-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one
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![4-benzyl-5-(3-hydroxypropylamino)-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/20220811/37b5abc11758401cb3dff5d871915e5a.png "4-benzyl-5-(3-hydroxypropylamino)-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one")
4-benzyl-5-(3-hydroxypropylamino)-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:
896083-25-3
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Formula:
C21H25N3O2S
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Chemical Name:
4-benzyl-5-(3-hydroxypropylamino)-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one
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Synonyms:
ZINC2441977;STK592719;AKOS005514817;MCULE-9355421882;3-benzyl-2-[(3-hydroxypropyl)amino]-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one;896083-25-3
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CAS No:
4-benzyl-5-(3-hydroxypropylamino)-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one Basic Attributes
383.5 g/mol
383.16674822 g/mol
Computed Properties
Molecular Weight:383.5
XLogP3:4.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:383.16674822
Monoisotopic Mass:383.16674822
Topological Polar Surface Area:93.2
Heavy Atom Count:27
Complexity:550
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 4-benzyl-5-(3-hydroxypropylamino)-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one
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