Chemical ID: 4433660

CC(C)Oc1ccccc1c2cc(c3cc(ccc3n2)Br)C(=O)O
Chemical ID:
4433660
Name [?]:
6-bromo-2-(2-isopropoxyphenyl)-quinoline-4-carboxylic acid
SMILES [?]:
CC(C)Oc1ccccc1c2cc(c3cc(ccc3n2)Br)C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H16BrNO3
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:9.54594
Area:521.014
Solvation:-3.4794
Coulombic:-40.816
Bond Count [?]
All:26
Single:17
Double:9
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:386.239
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.36
LogP (Chemaxon):5.03

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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