Chemical ID: 6533481

c1cc(ccc1c2csc(=NC(=O)c3cc(ccc3Cl)[N+](=O)[O-])[nH]2)[N+](=O)[O-]
Chemical ID:
6533481
Name [?]:
2-chloro-5-nitro-N-[4-(4-nitrophenyl)-3H-thiazol-2-ylidene]-benzamide
SMILES [?]:
c1cc(ccc1c2csc(=NC(=O)c3cc(ccc3Cl)[N+](=O)[O-])[nH]2)[N+](=O)[O-]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H9ClN4O5S
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:1.06429
Area:601.413
Solvation:-13.971
Coulombic:-49.2818
Bond Count [?]
All:29
Single:18
Double:11
Rotors:5
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:404.785
H-Bond Donors:0
H-Bond Acceptors:8
XLogP:4.63
LogP (Chemaxon):4.48

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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