Chemical ID: 5979953

Cc1c(c2ncc(c(n2n1)C)C(=O)N3CCCCC3)c4ccccc4
Chemical ID:
5979953
Name [?]:
(5,8-dimethyl-9-phenyl-2,6,7-triazabicyclo[4.3.0]nona-2,4,7,9-tetraen-4-yl)-(1-piperidyl)methanone
SMILES [?]:
Cc1c(c2ncc(c(n2n1)C)C(=O)N3CCCCC3)c4ccccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H22N4O
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:10.8751
Area:533.577
Solvation:-2.46435
Coulombic:-28.1987
Bond Count [?]
All:28
Single:20
Double:8
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:334.415
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.88
LogP (Chemaxon):2.65

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue