Chemical ID: 3873672

CC(C)(C)Nc1c(nc2n1cccc2)c3ccc(cc3)F
Chemical ID:
3873672
Name [?]:
8-(4-fluorophenyl)-N-tert-butyl-6,9-diazabicyclo[4.3.0]nona-2,4,7,9-tetraen-7-amine
SMILES [?]:
CC(C)(C)Nc1c(nc2n1cccc2)c3ccc(cc3)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H18FN3
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:8.58319
Area:441.572
Solvation:-2.45612
Coulombic:-28.731
Bond Count [?]
All:23
Single:16
Double:7
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:283.343
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:4.54
LogP (Chemaxon):3.91

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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