Chemical ID: 5927567

COc1ccc(c(c1)c2c(n3ccccc3n2)NCc4ccccc4)OC
Chemical ID:
5927567
Name [?]:
N-benzyl-8-(2,5-dimethoxyphenyl)-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraen-9-amine
SMILES [?]:
COc1ccc(c(c1)c2c(n3ccccc3n2)NCc4ccccc4)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H21N3O2
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:9.08894
Area:572.164
Solvation:-5.21516
Coulombic:-38.6784
Bond Count [?]
All:30
Single:20
Double:10
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:359.421
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.62
LogP (Chemaxon):4.21

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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