N-ethyl-2-[[12-oxo-11-(2-phenylethyl)-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl]sulfanyl]acetamide
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N-ethyl-2-[[12-oxo-11-(2-phenylethyl)-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl]sulfanyl]acetamide
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CAS No:
785704-88-3
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Formula:
C21H23N3O2S2
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Chemical Name:
N-ethyl-2-[[12-oxo-11-(2-phenylethyl)-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl]sulfanyl]acetamide
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Synonyms:
ZINC2628855;AKOS033911102;MCULE-8791656015;Z24356521;785704-88-3;N-ethyl-2-{[12-oxo-11-(2-phenylethyl)-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6),9-trien-10-yl]sulfanyl}acetamide
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CAS No:
N-ethyl-2-[[12-oxo-11-(2-phenylethyl)-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl]sulfanyl]acetamide Basic Attributes
413.6 g/mol
413.12316933 g/mol
Computed Properties
Molecular Weight:413.6
XLogP3:4.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:413.12316933
Monoisotopic Mass:413.12316933
Topological Polar Surface Area:115
Heavy Atom Count:28
Complexity:621
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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