Chemical ID: 7547597

Cn1c(nnc1SCc2ccc(cc2)[N+](=O)[O-])c3ccccc3F
Chemical ID:
7547597
Name [?]:
3-(2-fluorophenyl)-4-methyl-5-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazole
SMILES [?]:
Cn1c(nnc1SCc2ccc(cc2)[N+](=O)[O-])c3ccccc3F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H13FN4O2S
All Atoms:37
Heavy Atoms:24
Chiral Atoms:None
ZAP Information [?]
Total:5.39848
Area:541.723
Solvation:-8.14459
Coulombic:-29.8535
Bond Count [?]
All:26
Single:17
Double:9
Rotors:5
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:5.43
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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