Chemical ID: 7666669

c1ccc2c(c1)[nH]c(n2)c3c(n(nn3)c4cccc(c4)F)N
Chemical ID:
7666669
Name [?]:
None
SMILES [?]:
c1ccc2c(c1)[nH]c(n2)c3c(n(nn3)c4cccc(c4)F)N
InChi [?]:
InChI=1/C15H11FN6/c16-9-4-3-5-10(8-9)22-14(17)13(20-21-22)15-18-11-6-1-2-7-12(11)19-15/h1-8H,17H2,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,2,17,18,16,6,3,20,19,15,5,4,10,11,8,21,22,7,9,14,13,12/E:(1,2)(6,7)(11,12)(18,19)/rA:22nCCCCCCNCNCCNNNCCCCCCFN/rB:s1;d2;s3;d4;d1s5;s5;s7;s4d8;s8;d10;s11;s12;s10d13;s12;s15;d16;s17;d18;d15s19;s19;s11;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H11FN6
All Atoms:33
Heavy Atoms:22
Chiral Atoms:None
ZAP Information [?]
Total:9.19234
Area:468.349
Solvation:-2.51639
Coulombic:-44.2314
Bond Count [?]
All:25
Single:16
Double:9
Rotors:2
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:2.56
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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