Chemical ID: 5218509

c1ccc(cc1)C2(CN3CCSC3=N2)c4ccccc4
Chemical ID:
5218509
Name [?]:
7,7-diphenyl-4-thia-1,6-diazabicyclo[3.3.0]oct-5-ene
SMILES [?]:
c1ccc(cc1)C2(CN3CCSC3=N2)c4ccccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H16N2S
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:9.45742
Area:460.441
Solvation:-2.0536
Coulombic:-17.5355
Bond Count [?]
All:23
Single:16
Double:7
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:280.388
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:4.32
LogP (Chemaxon):4.39

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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