Chemical ID: 4874300

COc1ccc(cc1OC)C=C(C#N)c2nc3ccccc3o2
Chemical ID:
4874300
Name [?]:
2-benzooxazol-2-yl-3-(3,4-dimethoxyphenyl)-prop-2-enenitrile
SMILES [?]:
COc1ccc(cc1OC)C=C(C#N)c2nc3ccccc3o2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H14N2O3
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:7.5434
Area:513.69
Solvation:-5.29885
Coulombic:-33.1141
Bond Count [?]
All:25
Single:16
Double:8
Rotors:4
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:306.315
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:2.63
LogP (Chemaxon):3.67

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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