Chemical ID: 5797096

c1ccc(cc1)c2nnc(s2)NC(=O)c3cc(cc(c3)[N+](=O)[O-])[N+](=O)[O-]
Chemical ID:
5797096
Name [?]:
3,5-dinitro-N-(5-phenyl-1,3,4-thiadiazol-2-yl)-benzamide
SMILES [?]:
c1ccc(cc1)c2nnc(s2)NC(=O)c3cc(cc(c3)[N+](=O)[O-])[N+](=O)[O-]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C15H9N5O5S
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:-1.29452
Area:583.915
Solvation:-15.8924
Coulombic:-41.9131
Bond Count [?]
All:28
Single:17
Double:11
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:371.329
H-Bond Donors:1
H-Bond Acceptors:8
XLogP:3.72
LogP (Chemaxon):3.22

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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