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5-phenyl-6-thia-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),4,8-trien-2-one

5-phenyl-6-thia-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),4,8-trien-2-one structure

CAS No:
730997-81-6
Formula:
C15H12N2OS
Chemical Name:
5-phenyl-6-thia-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),4,8-trien-2-one
Synonyms:
MLS001006914;SMR000384384;CHEMBL1559500;BDBM57985;cid_2402618;HMS2697C10;ZINC3287133;AKOS034467530;MCULE-8961886749;Z56947546;5-phenyl-6-thia-1,8-diazatricyclo[7.3.0.0^{3,7}]dodeca-3(7),4,8-trien-2-one;730997-81-6

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5-phenyl-6-thia-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),4,8-trien-2-one Basic Attributes

Molecular Weight：

268.3 g/mol

Exact Mass：

268.06703418 g/mol

Characteristics

PSA：

60.9 Å²

Water Solubility：

1.5 [ug/mL]

Computed Properties

Molecular Weight:268.3
XLogP3:2.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:268.06703418
Monoisotopic Mass:268.06703418
Topological Polar Surface Area:60.9
Heavy Atom Count:19
Complexity:416
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-phenyl-6-thia-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),4,8-trien-2-one

Basic Attributes
Characteristics
Computed Properties

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