Chemical ID: 5161665

c1cc(oc1)c2cc(n3c(n2)cc(n3)C(=O)NCc4cccs4)C(F)(F)F
Chemical ID:
5161665
Name [?]:
4-(2-furyl)-N-(2-thienylmethyl)-2-(trifluoromethyl)-1,5,9-triazabicyclo[4.3.0]nona-2,4,6,8-tetraene-8-carboxamide
SMILES [?]:
c1cc(oc1)c2cc(n3c(n2)cc(n3)C(=O)NCc4cccs4)C(F)(F)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H11F3N4O2S
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:10.7575
Area:578.961
Solvation:-3.71657
Coulombic:-60.3868
Bond Count [?]
All:30
Single:21
Double:9
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:392.356
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.9
LogP (Chemaxon):3.09

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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