Chemical ID: 7245816

c1ccnc(c1)n2ccnc2C(=O)c3ccco3
Chemical ID:
7245816
Name [?]:
2-furyl-[1-(2-pyridyl)imidazol-2-yl]-methanone
SMILES [?]:
c1ccnc(c1)n2ccnc2C(=O)c3ccco3
InChi [?]:
InChI=1/C13H9N3O2/c17-12(10-4-3-9-18-10)13-15-7-8-16(13)11-5-1-2-6-14-11/h1-9H
InChi Info:
AuxInfo=1/0/N:1,2,16,15,6,3,9,8,17,14,5,12,11,4,10,7,13,18/rA:18nCCCNCCNCCNCCOCCCCO/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;s9;s7d10;s11;d12;s12;d14;s15;d16;s14s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H9N3O2
All Atoms:27
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:6.36603
Area:405.941
Solvation:-3.78248
Coulombic:-33.0565
Bond Count [?]
All:20
Single:12
Double:8
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:239.23
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:1.58
LogP (Chemaxon):1.48

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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