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12-(3,4-dimethylphenyl)sulfanyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraene

12-(3,4-dimethylphenyl)sulfanyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraene structure

CAS No:
794577-39-2
Formula:
C17H16N2S2
Chemical Name:
12-(3,4-dimethylphenyl)sulfanyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraene
Synonyms:
ZINC3326016;AKOS034151924;MCULE-3969813070;AB00980022-01;Z31114042;12-[(3,4-dimethylphenyl)sulfanyl]-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(12),2(6),8,10-tetraene;794577-39-2

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12-(3,4-dimethylphenyl)sulfanyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraene Basic Attributes

Molecular Weight：

312.5 g/mol

Exact Mass：

312.07549087 g/mol

Characteristics

PSA：

79.3 Å²

Computed Properties

Molecular Weight:312.5
XLogP3:5.4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:312.07549087
Monoisotopic Mass:312.07549087
Topological Polar Surface Area:79.3
Heavy Atom Count:21
Complexity:378
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 12-(3,4-dimethylphenyl)sulfanyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraene

Basic Attributes
Characteristics
Computed Properties

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