Chemical ID: 4347790

Cc1cccc(c1C)NC2=NC(=O)C(=Cc3cccc(c3)[N+](=O)[O-])S2
Chemical ID:
4347790
Name [?]:
2-(2,3-dimethylphenyl)amino-5-[(3-nitrophenyl)methylene]thiazol-4-one
SMILES [?]:
Cc1cccc(c1C)NC2=NC(=O)C(=Cc3cccc(c3)[N+](=O)[O-])S2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H15N3O3S
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:6.7702
Area:553.538
Solvation:-7.06825
Coulombic:-41.8383
Bond Count [?]
All:27
Single:17
Double:10
Rotors:4
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:353.396
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:3.79
LogP (Chemaxon):5.09

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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