Chemical ID: 5927951

Cc1ccc2nc(c(n2c1)NC3CCCCC3)c4ccc(cc4)C(C)(C)C
Chemical ID:
5927951
Name [?]:
N-cyclohexyl-4-methyl-8-(4-tert-butylphenyl)-6,9-diazabicyclo[4.3.0]nona-2,4,7,9-tetraen-7-amine
SMILES [?]:
Cc1ccc2nc(c(n2c1)NC3CCCCC3)c4ccc(cc4)C(C)(C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H31N3
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:13.046
Area:584.413
Solvation:-1.56434
Coulombic:-27.1877
Bond Count [?]
All:30
Single:23
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:361.523
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:6.87
LogP (Chemaxon):6.62

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