6-[[2-[(12-oxo-11-phenyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]acetyl]amino]hexanoic acid
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![6-[[2-[(12-oxo-11-phenyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]acetyl]amino]hexanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/2ba5d8e844eb4ff780e97f1f0be5c6f6.png "6-[[2-[(12-oxo-11-phenyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]acetyl]amino]hexanoic acid")
6-[[2-[(12-oxo-11-phenyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]acetyl]amino]hexanoic acid
structure -
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CAS No:
380341-63-9
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Formula:
C23H25N3O4S2
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Chemical Name:
6-[[2-[(12-oxo-11-phenyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]acetyl]amino]hexanoic acid
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Synonyms:
ZINC2638935;AKOS033635118;MCULE-5598782113;Z18649280;380341-63-9;6-[2-({12-oxo-11-phenyl-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6),9-trien-10-yl}sulfanyl)acetamido]hexanoic acid
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CAS No:
6-[[2-[(12-oxo-11-phenyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]acetyl]amino]hexanoic acid Basic Attributes
471.6 g/mol
471.12864863 g/mol
Computed Properties
Molecular Weight:471.6
XLogP3:4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:471.12864863
Monoisotopic Mass:471.12864863
Topological Polar Surface Area:153
Heavy Atom Count:32
Complexity:741
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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