Chemical ID: 3993428

c1ccc(cc1)c2csc3c2c(ncn3)Cl
Chemical ID:
3993428
Name [?]:
5-chloro-7-phenyl-9-thia-2,4-diazabicyclo[4.3.0]nona-1,3,5,7-tetraene
SMILES [?]:
c1ccc(cc1)c2csc3c2c(ncn3)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H7ClN2S
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:8.33997
Area:382.791
Solvation:-1.2298
Coulombic:-13.7544
Bond Count [?]
All:18
Single:11
Double:7
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:246.716
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:3.16
LogP (Chemaxon):3.96

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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