Chemical ID: 3918355

COc1ccc(cc1)CNc2c(nc3n2cccc3)c4ccc(c(c4)OC)OC
Chemical ID:
3918355
Name [?]:
8-(3,4-dimethoxyphenyl)-N-[(4-methoxyphenyl)methyl]-6,9-diazabicyclo[4.3.0]nona-2,4,7,9-tetraen-7-amine
SMILES [?]:
COc1ccc(cc1)CNc2c(nc3n2cccc3)c4ccc(c(c4)OC)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H23N3O3
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:8.50247
Area:616.556
Solvation:-6.91143
Coulombic:-45.6233
Bond Count [?]
All:32
Single:22
Double:10
Rotors:7
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:389.447
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.27
LogP (Chemaxon):3.96

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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