Chemical ID: 4135582

c1cc(cnc1)c2c(cn(n2)c3ccc(cc3)Br)C=O
Chemical ID:
4135582
Name [?]:
1-(4-bromophenyl)-3-(3-pyridyl)pyrazole-4-carbaldehyde
SMILES [?]:
c1cc(cnc1)c2c(cn(n2)c3ccc(cc3)Br)C=O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C15H10BrN3O
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:8.40944
Area:472.977
Solvation:-3.41499
Coulombic:-16.2405
Bond Count [?]
All:22
Single:13
Double:9
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:328.164
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:3.18
LogP (Chemaxon):3.24

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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