Chemical ID: 5567609

c1ccc(cc1)c2c3c(nc(s3)C#N)n(n2)c4ccccc4
Chemical ID:
5567609
Name [?]:
6,8-diphenyl-2-thia-4,6,7-triazabicyclo[3.3.0]octa-3,7,9-triene-3-carbonitrile
SMILES [?]:
c1ccc(cc1)c2c3c(nc(s3)C#N)n(n2)c4ccccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H10N4S
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:10.9162
Area:502.956
Solvation:-1.65767
Coulombic:-19.2419
Bond Count [?]
All:25
Single:15
Double:9
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:302.354
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:3.34
LogP (Chemaxon):4.96

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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