Chemical ID: 5960070

c1cc(ccc1Cc2nc(sn2)N3CCN(CC3)C(=O)c4ccc(cc4)[N+](=O)[O-])F
Chemical ID:
5960070
Name [?]:
[4-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]piperazin-1-yl]-(4-nitrophenyl)-methanone
SMILES [?]:
c1cc(ccc1Cc2nc(sn2)N3CCN(CC3)C(=O)c4ccc(cc4)[N+](=O)[O-])F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H18FN5O3S
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:6.2405
Area:634.977
Solvation:-9.63394
Coulombic:-49.6245
Bond Count [?]
All:33
Single:23
Double:10
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:427.453
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:3.5
LogP (Chemaxon):4.73

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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