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Chemical ID: 4634587
Chemical ID:
4634587
Name [?]:
4-(5-amino-1,3,4-oxadiazol-2-yl)-1,2,5-oxadiazol-3-amine
SMILES [?]:
c1(c(non1)N)c2nnc(o2)N
InChi [?]:
InChI=1/C4H4N6O2/c5-2-1(9-12-10-2)3-7-8-4(6)11-3/h(H2,5,10)(H2,6,8)
InChi Info:
AuxInfo=1/1/N:1,2,7,10,6,12,8,9,5,3,11,4/rA:12nCCNONNCNNCON/rB:s1;d2;s3;d1s4;s2;s1;d7;s8;d9;s7s10;s10;/rC:;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C4H4N6O2 |
All Atoms: | 12 |
Heavy Atoms: | 12 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.31763 |
Area: | 316.59 |
Solvation: | -1.59713 |
Coulombic: | -51.1599 |
Bond Count [?]
All: | 13 |
Single: | 9 |
Double: | 4 |
Rotors: | 1 |
Chiral: | 0 |
Rigid Segments: | 2 |
Chemical Properties
Molecular Weight: | 168.114 |
H-Bond Donors: | 4 |
H-Bond Acceptors: | 2 |
XLogP: | 1.08 |
LogP (Chemaxon): | -0.83 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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