Chemical ID: 4764750

CC(C)(C)c1cc2nc(cc(n2n1)N3CCNCC3)C(F)(F)F
Chemical ID:
4764750
Name [?]:
5-piperazin-1-yl-8-tert-butyl-3-(trifluoromethyl)-2,6,7-triazabicyclo[4.3.0]nona-2,4,7,9-tetraene
SMILES [?]:
CC(C)(C)c1cc2nc(cc(n2n1)N3CCNCC3)C(F)(F)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C15H20F3N5
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:8.97271
Area:484.502
Solvation:-3.13983
Coulombic:-44.3203
Bond Count [?]
All:25
Single:21
Double:4
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:327.348
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.15
LogP (Chemaxon):3.87

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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