Chemical ID: 4135524

c1cc(ccc1c2c(cn(n2)c3ccc(cc3)Cl)C=O)Br
Chemical ID:
4135524
Name [?]:
3-(4-bromophenyl)-1-(4-chlorophenyl)-pyrazole-4-carbaldehyde
SMILES [?]:
c1cc(ccc1c2c(cn(n2)c3ccc(cc3)Cl)C=O)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H10BrClN2O
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:9.86747
Area:510.007
Solvation:-2.8827
Coulombic:-13.6126
Bond Count [?]
All:23
Single:14
Double:9
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:361.62
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:5.06
LogP (Chemaxon):5.07

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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