Chemical ID: 5580532

c1(c(nc(c(n1)Cl)N)N)C(=O)NC(=N)N
Chemical ID:
5580532
Name [?]:
N-amidino-3,5-diamino-6-chloro-pyrazine-2-carboxamide
SMILES [?]:
c1(c(nc(c(n1)Cl)N)N)C(=O)NC(=N)N
InChi [?]:
InChI=1/C6H8ClN7O/c7-2-4(9)13-3(8)1(12-2)5(15)14-6(10)11/h(H4,8,9,13)(H4,10,11,14,15)
InChi Info:
AuxInfo=1/1/N:1,5,2,4,10,13,7,9,8,14,15,6,3,12,11/E:(10,11)/rA:15nCCNCCNClNNCONCNN/rB:s1;d2;s3;d4;d1s5;s5;s4;s2;s1;d10;s10;s12;w13;s13;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C6H8ClN7O
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:7.15663
Area:387.812
Solvation:-2.53868
Coulombic:-93.8482
Bond Count [?]
All:15
Single:10
Double:5
Rotors:3
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:229.627
H-Bond Donors:8
H-Bond Acceptors:6
XLogP:0.17
LogP (Chemaxon):-0.09

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