Chemical ID: 7221830

Cc1ccn(n1)C(C)c2nc3c4ccccc4ncn3n2
Chemical ID:
7221830
Name [?]:
None
SMILES [?]:
Cc1ccn(n1)C(C)c2nc3c4ccccc4ncn3n2
InChi [?]:
InChI=1/C15H14N6/c1-10-7-8-20(18-10)11(2)14-17-15-12-5-3-4-6-13(12)16-9-21(15)19-14/h3-9,11H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,8,14,15,13,16,3,4,19,2,7,12,17,9,11,18,10,6,21,5,20/rA:21cCCCCNNCCCNCCCCCCCNCNN/rB:s1;s2;d3;s4;d2s5;s5;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:9.03192
Area:467.053
Solvation:-2.64441
Coulombic:-21.6918
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:2.24
LogP (Chemaxon):3.17

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Experimental Annotations

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Descriptor Annotations

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