Chemical ID: 3990931

Cc1c(c2c(n1c3cccc(c3)C(F)(F)F)CCC(=C2Cl)C=O)Br
Chemical ID:
3990931
Name [?]:
3-bromo-4-chloro-2-methyl-1-[3-(trifluoromethyl)phenyl]-6,7-dihydroindole-5-carbaldehyde
SMILES [?]:
Cc1c(c2c(n1c3cccc(c3)C(F)(F)F)CCC(=C2Cl)C=O)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H12BrClF3NO
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:9.97054
Area:510.765
Solvation:-2.79858
Coulombic:-31.6148
Bond Count [?]
All:26
Single:19
Double:7
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:418.635
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:4.82
LogP (Chemaxon):3.73

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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