Chemical ID: 5289665

Cc1ccc(c(c1)NC=C(C#N)c2nc3ccccc3n2C)OC
Chemical ID:
5289665
Name [?]:
3-(2-methoxy-5-methyl-phenyl)amino-2-(1-methylbenzoimidazol-2-yl)-prop-2-enenitrile
SMILES [?]:
Cc1ccc(c(c1)NC=C(C#N)c2nc3ccccc3n2C)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H18N4O
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:10.1561
Area:536.382
Solvation:-3.25343
Coulombic:-35.7846
Bond Count [?]
All:26
Single:17
Double:8
Rotors:4
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:318.373
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.85
LogP (Chemaxon):3.98

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue