Chemical ID: 5583900

COc1cc(cc(c1OC)OC)C=NNc2nc(nc(n2)N3CCCCC3)N4CCCCC4
Chemical ID:
5583900
Name [?]:
4,6-bis(1-piperidyl)-N-[(3,4,5-trimethoxyphenyl)methyleneamino]-1,3,5-triazin-2-amine
SMILES [?]:
COc1cc(cc(c1OC)OC)C=NNc2nc(nc(n2)N3CCCCC3)N4CCCCC4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H33N7O3
All Atoms:33
Heavy Atoms:33
Chiral Atoms:0
ZAP Information [?]
Total:9.94108
Area:676.923
Solvation:-6.98198
Coulombic:-65.3519
Bond Count [?]
All:36
Single:29
Double:7
Rotors:8
Chiral:1
Rigid Segments:8
Chemical Properties
Molecular Weight:455.553
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:4.89
LogP (Chemaxon):4.6

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