3,7-dichloro-2-(4-hydroxyphenyl)indazol-6-ol

C13H8Cl2N2O2 — CID 135442612

IUPAC3,7-dichloro-2-(4-hydroxyphenyl)indazol-6-ol
SMILESOc1ccc(-n2nc3c(Cl)c(O)ccc3c2Cl)cc1
InChIInChI=1S/C13H8Cl2N2O2/c14-11-10(19)6-5-9-12(11)16-17(13(9)15)7-1-3-8(18)4-2-7/h1-6,18-19H
InChIKeyUAFCTCIOVJPVSQ-UHFFFAOYSA-N
MW295.12 g/mol
LogP3.74
Rot. Bonds1

About 3,7-dichloro-2-(4-hydroxyphenyl)indazol-6-ol

3,7-dichloro-2-(4-hydroxyphenyl)indazol-6-ol (PubChem CID 135442612) has the molecular formula C13H8Cl2N2O2 and a molecular weight of 295.12 g/mol. Its IUPAC name is 3,7-dichloro-2-(4-hydroxyphenyl)indazol-6-ol.

Molecular Properties

Compound Name3,7-dichloro-2-(4-hydroxyphenyl)indazol-6-ol
PubChem CID135442612
Molecular FormulaC13H8Cl2N2O2
Molecular Weight295.12 g/mol
Exact Mass294.00
IUPAC Name3,7-dichloro-2-(4-hydroxyphenyl)indazol-6-ol
SMILESOc1ccc(-n2nc3c(Cl)c(O)ccc3c2Cl)cc1
InChIInChI=1S/C13H8Cl2N2O2/c14-11-10(19)6-5-9-12(11)16-17(13(9)15)7-1-3-8(18)4-2-7/h1-6,18-19H
InChIKeyUAFCTCIOVJPVSQ-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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Related Compounds

CID 11368987
CID 11368987
CID 11172616
CID 11172616
CID 11368562
CID 11368562
CID 11449301
CID 11449301
CID 135440293
CID 135440293
CID 135461934
CID 135461934
CID 163234133
CID 163234133
CID 170685637
CID 170685637
CID 170685701
CID 170685701
CID 184765
CID 184765
CID 185078
CID 185078
CID 135700179
CID 135700179

Frequently Asked Questions

What is the IUPAC name of 3,7-dichloro-2-(4-hydroxyphenyl)indazol-6-ol?
The IUPAC name of 3,7-dichloro-2-(4-hydroxyphenyl)indazol-6-ol (CID 135442612) is 3,7-dichloro-2-(4-hydroxyphenyl)indazol-6-ol.
What is the SMILES notation for 3,7-dichloro-2-(4-hydroxyphenyl)indazol-6-ol?
The canonical SMILES for 3,7-dichloro-2-(4-hydroxyphenyl)indazol-6-ol is Oc1ccc(-n2nc3c(Cl)c(O)ccc3c2Cl)cc1.
What is the InChIKey of 3,7-dichloro-2-(4-hydroxyphenyl)indazol-6-ol?
The InChIKey is UAFCTCIOVJPVSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Cl2N2O2/c14-11-10(19)6-5-9-12(11)16-17(13(9)15)7-1-3-8(18)4-2-7/h1-6,18-19H.
What are the key properties of 3,7-dichloro-2-(4-hydroxyphenyl)indazol-6-ol?
3,7-dichloro-2-(4-hydroxyphenyl)indazol-6-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 3,7-dichloro-2-(4-hydroxyphenyl)indazol-6-ol is sourced from PubChem (CID 135442612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).