Chemical ID: 4135798

Cc1ccccc1n2c(cc(n2)c3ccc(cc3)Br)C(=O)O
Chemical ID:
4135798
Name [?]:
5-(4-bromophenyl)-2-(o-tolyl)pyrazole-3-carboxylic acid
SMILES [?]:
Cc1ccccc1n2c(cc(n2)c3ccc(cc3)Br)C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H13BrN2O2
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:9.98908
Area:492.692
Solvation:-2.32822
Coulombic:-35.1846
Bond Count [?]
All:24
Single:15
Double:9
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:357.201
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.67
LogP (Chemaxon):4.62

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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