Chemical ID: 4857030

COc1ccccc1C(=O)Nc2c(nc3n2cccc3)c4ccc5ccccc5c4
Chemical ID:
4857030
Name [?]:
2-methoxy-N-[8-(2-naphthyl)-6,9-diazabicyclo[4.3.0]nona-2,4,7,9-tetraen-7-yl]-benzamide
SMILES [?]:
COc1ccccc1C(=O)Nc2c(nc3n2cccc3)c4ccc5ccccc5c4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H19N3O2
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:9.97151
Area:598.88
Solvation:-5.0005
Coulombic:-42.0139
Bond Count [?]
All:34
Single:21
Double:13
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:393.437
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.59
LogP (Chemaxon):5.17

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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