Chemical ID: 7222190

Cc1ccnn1C(C)c2nc3c4ccccc4ncn3n2
Chemical ID:
7222190
Name [?]:
None
SMILES [?]:
Cc1ccnn1C(C)c2nc3c4ccccc4ncn3n2
InChi [?]:
InChI=1/C15H14N6/c1-10-7-8-17-21(10)11(2)14-18-15-12-5-3-4-6-13(12)16-9-20(15)19-14/h3-9,11H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,8,14,15,13,16,3,4,19,2,7,12,17,9,11,18,5,10,21,20,6/rA:21cCCCCNNCCCNCCCCCCCNCNN/rB:s1;d2;s3;d4;s2s5;s6;s7;s7;s9;d10;s11;s12;d13;s14;d15;d12s16;s17;d18;s11s19;d9s20;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H14N6
All Atoms:35
Heavy Atoms:21
Chiral Atoms:1
ZAP Information [?]
Total:8.69272
Area:462.981
Solvation:-2.88181
Coulombic:-21.1787
Bond Count [?]
All:24
Single:16
Double:8
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:278.312
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:2.33
LogP (Chemaxon):3.02

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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