Chemical ID: 7221673

Cc1cc(nn1C)c2nc3c4ccccc4ncn3n2
Chemical ID:
7221673
Name [?]:
None
SMILES [?]:
Cc1cc(nn1C)c2nc3c4ccccc4ncn3n2
InChi [?]:
InChI=1/C14H12N6/c1-9-7-12(17-19(9)2)13-16-14-10-5-3-4-6-11(10)15-8-20(14)18-13/h3-8H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,7,13,14,12,15,3,18,2,11,16,4,8,10,17,9,5,20,6,19/rA:20nCCCCNNCCNCCCCCCCNCNN/rB:s1;d2;s3;d4;s2s5;s6;s4;s8;d9;s10;s11;d12;s13;d14;d11s15;s16;d17;s10s18;d8s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H12N6
All Atoms:32
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:8.9011
Area:449.516
Solvation:-2.3368
Coulombic:-22.5656
Bond Count [?]
All:23
Single:15
Double:8
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:264.286
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:1.96
LogP (Chemaxon):2.24

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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