Chemical ID: 4453747

COc1ccc(c(c1)OC)c2nc(no2)c3ccc(cc3)Br
Chemical ID:
4453747
Name [?]:
3-(4-bromophenyl)-5-(2,4-dimethoxyphenyl)-1,2,4-oxadiazole
SMILES [?]:
COc1ccc(c(c1)OC)c2nc(no2)c3ccc(cc3)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H13BrN2O3
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:8.62484
Area:510.466
Solvation:-4.13682
Coulombic:-27.748
Bond Count [?]
All:24
Single:16
Double:8
Rotors:4
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:361.19
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:4.73
LogP (Chemaxon):4.36

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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