Chemical ID: 3918475

Cc1cccc2n1c(c(n2)c3ccc(c(c3)OC)OC)NCc4ccc(cc4)F
Chemical ID:
3918475
Name [?]:
8-(3,4-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]-5-methyl-6,9-diazabicyclo[4.3.0]nona-2,4,7,9-tetraen-7-amine
SMILES [?]:
Cc1cccc2n1c(c(n2)c3ccc(c(c3)OC)OC)NCc4ccc(cc4)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H22FN3O2
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:8.21012
Area:582.648
Solvation:-6.35608
Coulombic:-42.0339
Bond Count [?]
All:32
Single:22
Double:10
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:391.438
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.75
LogP (Chemaxon):4.37

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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