Chemical ID: 6441607

Cc1ccc(cc1)n2c(cc3c2CC(CC3=O)(C)C)c4ccc(cc4)Br
Chemical ID:
6441607
Name [?]:
2-(4-bromophenyl)-6,6-dimethyl-1-(p-tolyl)-5,7-dihydroindol-4-one
SMILES [?]:
Cc1ccc(cc1)n2c(cc3c2CC(CC3=O)(C)C)c4ccc(cc4)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H22BrNO
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:11.7821
Area:554.36
Solvation:-2.07694
Coulombic:-16.2739
Bond Count [?]
All:29
Single:20
Double:9
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:408.331
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:6.79
LogP (Chemaxon):5.7

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