Chemical ID: 6494264

CCn1c2ccccc2nc1c3c(non3)N
Chemical ID:
6494264
Name [?]:
4-(1-ethylbenzoimidazol-2-yl)-1,2,5-oxadiazol-3-amine
SMILES [?]:
CCn1c2ccccc2nc1c3c(non3)N
InChi [?]:
InChI=1/C11H11N5O/c1-2-16-8-6-4-3-5-7(8)13-11(16)9-10(12)15-17-14-9/h3-6H,2H2,1H3,(H2,12,15)
InChi Info:
AuxInfo=1/1/N:1,2,7,6,8,5,9,4,12,13,11,17,10,16,14,3,15/rA:17nCCNCCCCCCNCCCNONN/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s3d10;s11;s12;d13;s14;d12s15;s13;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H11N5O
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.34573
Area:390.74
Solvation:-1.42276
Coulombic:-34.1116
Bond Count [?]
All:19
Single:13
Double:6
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:229.238
H-Bond Donors:2
H-Bond Acceptors:1
XLogP:2.51
LogP (Chemaxon):2.57

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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