Chemical ID: 3934028

Cn1c(nnc1SCC(=O)Nc2cccc(c2)F)c3ccccc3N
Chemical ID:
3934028
Name [?]:
2-[[5-(2-aminophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-fluorophenyl)-acetamide
SMILES [?]:
Cn1c(nnc1SCC(=O)Nc2cccc(c2)F)c3ccccc3N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H16FN5OS
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:10.0405
Area:557.578
Solvation:-3.899
Coulombic:-53.2525
Bond Count [?]
All:27
Single:18
Double:9
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:357.406
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:3.87
LogP (Chemaxon):2.65

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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