Chemical ID: 3968854

CCC1c2cc(c(cc2C(=NN=C1C)c3ccc(c(c3)OC)OC)OC)OC
Chemical ID:
3968854
Name [?]:
6-(3,4-dimethoxyphenyl)-2-ethyl-9,10-dimethoxy-3-methyl-4,5-diazabicyclo[5.4.0]undeca-3,5,8,10,12-pentaene
SMILES [?]:
CCC1c2cc(c(cc2C(=NN=C1C)c3ccc(c(c3)OC)OC)OC)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H26N2O4
All Atoms:28
Heavy Atoms:28
Chiral Atoms:1
ZAP Information [?]
Total:5.83756
Area:576.932
Solvation:-8.58574
Coulombic:-30.841
Bond Count [?]
All:30
Single:22
Double:8
Rotors:6
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:382.453
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:4.47
LogP (Chemaxon):3.2

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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