Chemical ID: 6647047

Cc1ccccc1C(=O)Oc2ccc(cc2)C=NNC(=O)c3cc(c(c(c3)OC)OC)OC
Chemical ID:
6647047
Name [?]:
[4-[(3,4,5-trimethoxybenzoyl)aminoiminomethyl]phenyl] 2-methylbenzoate
SMILES [?]:
Cc1ccccc1C(=O)Oc2ccc(cc2)C=NNC(=O)c3cc(c(c(c3)OC)OC)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H24N2O6
All Atoms:33
Heavy Atoms:33
Chiral Atoms:0
ZAP Information [?]
Total:8.64832
Area:677.527
Solvation:-8.28986
Coulombic:-60.685
Bond Count [?]
All:35
Single:23
Double:12
Rotors:10
Chiral:1
Rigid Segments:9
Chemical Properties
Molecular Weight:448.468
H-Bond Donors:1
H-Bond Acceptors:8
XLogP:5.28
LogP (Chemaxon):4.18

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