Chemical ID: 4121306

Cc1ccc2c(n[nH]c2n1)N
Chemical ID:
4121306
Name [?]:
4-methyl-5,7,8-triazabicyclo[4.3.0]nona-2,4,8,10-tetraen-9-amine
SMILES [?]:
Cc1ccc2c(n[nH]c2n1)N
InChi [?]:
InChI=1/C7H8N4/c1-4-2-3-5-6(8)10-11-7(5)9-4/h2-3H,1H3,(H3,8,9,10,11)
InChi Info:
AuxInfo=1/1/N:1,3,4,2,5,6,9,11,10,7,8/rA:11nCCCCCCNNCNN/rB:s1;s2;d3;s4;s5;d6;s7;d5s8;d2s9;s6;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H8N4
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:5.74897
Area:298.048
Solvation:-1.70224
Coulombic:-31.9609
Bond Count [?]
All:12
Single:8
Double:4
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:148.165
H-Bond Donors:2
H-Bond Acceptors:1
XLogP:1.45
LogP (Chemaxon):0.97

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Descriptor Annotations

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