Chemical ID: 4257010

c1ccc2c(c1)nc(s2)C(=N[O-])C#N
Chemical ID:
4257010
Name [?]:
2-benzothiazol-2-yl-2-oxidoimino-acetonitrile
SMILES [?]:
c1ccc2c(c1)nc(s2)C(=N[O-])C#N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C9H4N3OS-
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:-33.2464
Area:367.846
Solvation:-42.4426
Coulombic:5.99195
Bond Count [?]
All:15
Single:9
Double:5
Rotors:1
Chiral:1
Rigid Segments:2
Chemical Properties
Molecular Weight:202.214
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:1.11
LogP (Chemaxon):2.56

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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