Chemical ID: 4854923

COc1ccc(cc1)C(=O)Nc2c(nc3n2cccc3)c4ccccc4
Chemical ID:
4854923
Name [?]:
4-methoxy-N-(8-phenyl-6,9-diazabicyclo[4.3.0]nona-2,4,7,9-tetraen-7-yl)-benzamide
SMILES [?]:
COc1ccc(cc1)C(=O)Nc2c(nc3n2cccc3)c4ccccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H17N3O2
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:9.62706
Area:548.068
Solvation:-4.07463
Coulombic:-42.252
Bond Count [?]
All:29
Single:18
Double:11
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:343.379
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.32
LogP (Chemaxon):4.17

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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