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

C13H8Cl2N2O2 — CID 152718014

IUPAC3-chloro-2-(2-chloro-4-hydroxyphenyl)indazol-5-ol
SMILESOc1ccc(-n2nc3ccc(O)cc3c2Cl)c(Cl)c1
InChIInChI=1S/C13H8Cl2N2O2/c14-10-6-8(19)2-4-12(10)17-13(15)9-5-7(18)1-3-11(9)16-17/h1-6,18-19H
InChIKeyZVABUXYYAKEEKC-UHFFFAOYSA-N
MW295.12 g/mol
LogP3.74
Rot. Bonds1

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

3-chloro-2-(2-chloro-4-hydroxyphenyl)indazol-5-ol (PubChem CID 152718014) has the molecular formula C13H8Cl2N2O2 and a molecular weight of 295.12 g/mol. Its IUPAC name is 3-chloro-2-(2-chloro-4-hydroxyphenyl)indazol-5-ol.

Molecular Properties

Compound Name3-chloro-2-(2-chloro-4-hydroxyphenyl)indazol-5-ol
PubChem CID152718014
Molecular FormulaC13H8Cl2N2O2
Molecular Weight295.12 g/mol
Exact Mass294.00
IUPAC Name3-chloro-2-(2-chloro-4-hydroxyphenyl)indazol-5-ol
SMILESOc1ccc(-n2nc3ccc(O)cc3c2Cl)c(Cl)c1
InChIInChI=1S/C13H8Cl2N2O2/c14-10-6-8(19)2-4-12(10)17-13(15)9-5-7(18)1-3-11(9)16-17/h1-6,18-19H
InChIKeyZVABUXYYAKEEKC-UHFFFAOYSA-N
XLogP3.74
TPSA58.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.12
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-(2-chloro-4-hydroxyphenyl)indazol-5-ol?
The IUPAC name of 3-chloro-2-(2-chloro-4-hydroxyphenyl)indazol-5-ol (CID 152718014) is 3-chloro-2-(2-chloro-4-hydroxyphenyl)indazol-5-ol.
What is the SMILES notation for 3-chloro-2-(2-chloro-4-hydroxyphenyl)indazol-5-ol?
The canonical SMILES for 3-chloro-2-(2-chloro-4-hydroxyphenyl)indazol-5-ol is Oc1ccc(-n2nc3ccc(O)cc3c2Cl)c(Cl)c1.
What is the InChIKey of 3-chloro-2-(2-chloro-4-hydroxyphenyl)indazol-5-ol?
The InChIKey is ZVABUXYYAKEEKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Cl2N2O2/c14-10-6-8(19)2-4-12(10)17-13(15)9-5-7(18)1-3-11(9)16-17/h1-6,18-19H.
What are the key properties of 3-chloro-2-(2-chloro-4-hydroxyphenyl)indazol-5-ol?
3-chloro-2-(2-chloro-4-hydroxyphenyl)indazol-5-ol has a molecular weight of 295.12 g/mol, XLogP of 3.74, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-(2-chloro-4-hydroxyphenyl)indazol-5-ol is sourced from PubChem (CID 152718014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).