Chemical ID: 6622010

CCCCc1nc(nn1N)SCC(=O)Nc2cccc(c2)C(F)(F)F
Chemical ID:
6622010
Name [?]:
2-[(1-amino-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]-acetamide
SMILES [?]:
CCCCc1nc(nn1N)SCC(=O)Nc2cccc(c2)C(F)(F)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C15H18F3N5OS
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:10.414
Area:581.151
Solvation:-4.11475
Coulombic:-61.1928
Bond Count [?]
All:26
Single:20
Double:6
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:373.398
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:2.78
LogP (Chemaxon):3.96

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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