Chemical ID: 5283641

Cc1nc2c3cnn(c3ncn2n1)c4ccc(cc4)F
Chemical ID:
5283641
Name [?]:
None
SMILES [?]:
Cc1nc2c3cnn(c3ncn2n1)c4ccc(cc4)F
InChi [?]:
InChI=1/C13H9FN6/c1-8-17-13-11-6-16-20(10-4-2-9(14)3-5-10)12(11)15-7-19(13)18-8/h2-7H,1H3
InChi Info:
AuxInfo=1/0/N:1,16,18,15,19,6,11,2,17,14,5,9,4,20,10,7,3,13,12,8/E:(2,3)(4,5)/rA:20nCCNCCCNNCNCNNCCCCCCF/rB:s1;s2;d3;s4;s5;d6;s7;d5s8;s9;d10;s4s11;d2s12;s8;s14;d15;s16;d17;d14s18;s17;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H9FN6
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:7.82987
Area:428.754
Solvation:-2.88898
Coulombic:-24.6613
Bond Count [?]
All:23
Single:15
Double:8
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:268.249
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:1.91
LogP (Chemaxon):2.95

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Descriptor Annotations

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