3-chloro-2-(4-hydroxyphenyl)indazol-5-ol

C13H9ClN2O2 — CID 11368987

IUPAC3-chloro-2-(4-hydroxyphenyl)indazol-5-ol
SMILESOc1ccc(-n2nc3ccc(O)cc3c2Cl)cc1
InChIInChI=1S/C13H9ClN2O2/c14-13-11-7-10(18)5-6-12(11)15-16(13)8-1-3-9(17)4-2-8/h1-7,17-18H
InChIKeyZNHQDSBJVFFIAK-UHFFFAOYSA-N
MW260.68 g/mol
LogP3.09
Rot. Bonds1

About 3-chloro-2-(4-hydroxyphenyl)indazol-5-ol

3-chloro-2-(4-hydroxyphenyl)indazol-5-ol (PubChem CID 11368987) has the molecular formula C13H9ClN2O2 and a molecular weight of 260.68 g/mol. Its IUPAC name is 3-chloro-2-(4-hydroxyphenyl)indazol-5-ol.

Molecular Properties

Compound Name3-chloro-2-(4-hydroxyphenyl)indazol-5-ol
PubChem CID11368987
Molecular FormulaC13H9ClN2O2
Molecular Weight260.68 g/mol
Exact Mass260.04
IUPAC Name3-chloro-2-(4-hydroxyphenyl)indazol-5-ol
SMILESOc1ccc(-n2nc3ccc(O)cc3c2Cl)cc1
InChIInChI=1S/C13H9ClN2O2/c14-13-11-7-10(18)5-6-12(11)15-16(13)8-1-3-9(17)4-2-8/h1-7,17-18H
InChIKeyZNHQDSBJVFFIAK-UHFFFAOYSA-N
XLogP3.09
TPSA58.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.68
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-(4-hydroxyphenyl)indazol-5-ol?
The IUPAC name of 3-chloro-2-(4-hydroxyphenyl)indazol-5-ol (CID 11368987) is 3-chloro-2-(4-hydroxyphenyl)indazol-5-ol.
What is the SMILES notation for 3-chloro-2-(4-hydroxyphenyl)indazol-5-ol?
The canonical SMILES for 3-chloro-2-(4-hydroxyphenyl)indazol-5-ol is Oc1ccc(-n2nc3ccc(O)cc3c2Cl)cc1.
What is the InChIKey of 3-chloro-2-(4-hydroxyphenyl)indazol-5-ol?
The InChIKey is ZNHQDSBJVFFIAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9ClN2O2/c14-13-11-7-10(18)5-6-12(11)15-16(13)8-1-3-9(17)4-2-8/h1-7,17-18H.
What are the key properties of 3-chloro-2-(4-hydroxyphenyl)indazol-5-ol?
3-chloro-2-(4-hydroxyphenyl)indazol-5-ol has a molecular weight of 260.68 g/mol, XLogP of 3.09, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-(4-hydroxyphenyl)indazol-5-ol is sourced from PubChem (CID 11368987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).