Chemical ID: 5844676

COc1cc(cc(c1OC)OC)C(=O)Oc2cccc(c2)C=NNC(=O)c3ccc4c(c3)OCO4
Chemical ID:
5844676
Name [?]:
[3-(benzo[1,3]dioxol-5-ylcarbonylaminoiminomethyl)phenyl] 3,4,5-trimethoxybenzoate
SMILES [?]:
COc1cc(cc(c1OC)OC)C(=O)Oc2cccc(c2)C=NNC(=O)c3ccc4c(c3)OCO4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H22N2O8
All Atoms:35
Heavy Atoms:35
Chiral Atoms:0
ZAP Information [?]
Total:8.12919
Area:719.505
Solvation:-9.85843
Coulombic:-75.1764
Bond Count [?]
All:38
Single:26
Double:12
Rotors:10
Chiral:1
Rigid Segments:9
Chemical Properties
Molecular Weight:478.451
H-Bond Donors:1
H-Bond Acceptors:10
XLogP:4.6
LogP (Chemaxon):3.4

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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