4-chloro-5-fluoro-1-(2-hydroxy-4-phenylphenyl)indazol-6-ol

C19H12ClFN2O2 — CID 175464773

IUPAC4-chloro-5-fluoro-1-(2-hydroxy-4-phenylphenyl)indazol-6-ol
SMILESOc1cc(-c2ccccc2)ccc1-n1ncc2c(Cl)c(F)c(O)cc21
InChIInChI=1S/C19H12ClFN2O2/c20-18-13-10-22-23(15(13)9-17(25)19(18)21)14-7-6-12(8-16(14)24)11-4-2-1-3-5-11/h1-10,24-25H
InChIKeyQDZJKIQSXQOZAC-UHFFFAOYSA-N
MW354.77 g/mol
LogP4.90
Rot. Bonds2

About 4-chloro-5-fluoro-1-(2-hydroxy-4-phenylphenyl)indazol-6-ol

4-chloro-5-fluoro-1-(2-hydroxy-4-phenylphenyl)indazol-6-ol (PubChem CID 175464773) has the molecular formula C19H12ClFN2O2 and a molecular weight of 354.77 g/mol. Its IUPAC name is 4-chloro-5-fluoro-1-(2-hydroxy-4-phenylphenyl)indazol-6-ol.

Molecular Properties

Compound Name4-chloro-5-fluoro-1-(2-hydroxy-4-phenylphenyl)indazol-6-ol
PubChem CID175464773
Molecular FormulaC19H12ClFN2O2
Molecular Weight354.77 g/mol
Exact Mass354.06
IUPAC Name4-chloro-5-fluoro-1-(2-hydroxy-4-phenylphenyl)indazol-6-ol
SMILESOc1cc(-c2ccccc2)ccc1-n1ncc2c(Cl)c(F)c(O)cc21
InChIInChI=1S/C19H12ClFN2O2/c20-18-13-10-22-23(15(13)9-17(25)19(18)21)14-7-6-12(8-16(14)24)11-4-2-1-3-5-11/h1-10,24-25H
InChIKeyQDZJKIQSXQOZAC-UHFFFAOYSA-N
XLogP4.90
TPSA58.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.77
LogP ≤ 54.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-fluoro-1-[4-(3-hydroxyphenyl)phenyl]-4-(trifluoromethyl)indazol-6-ol
CID 163233721
2-(6-fluoroindazol-1-yl)phenol
CID 105485286
2,3-difluoro-5-phenylphenol
CID 46314774
4,7-difluoro-6-methyl-1-(4-phenylphenyl)indazole
CID 163233433
2-(2-hydroxy-5-phenylphenyl)isoindole-1,3-dione
CID 172816756
2-(5-chloro-4-phenoxypyrazol-1-yl)phenol
CID 117232967
2-methyl-4-(4-phenylphenyl)phenol
CID 83131251
4-[5-(2-phenylphenyl)-4-sulfanyltriazol-1-yl]benzene-1,3-diol
CID 25031143
5-chloro-1-phenylpyrazol-4-ol
CID 117232897
4-chloro-1-phenylpyrazolo[3,4-c]pyridine-5-carboxylic acid
CID 122458585
9-(2-methyl-4-phenylphenyl)carbazole
CID 143868574
9-(2-chloro-5-phenylphenyl)carbazole
CID 156755659

Frequently Asked Questions

What is the IUPAC name of 4-chloro-5-fluoro-1-(2-hydroxy-4-phenylphenyl)indazol-6-ol?
The IUPAC name of 4-chloro-5-fluoro-1-(2-hydroxy-4-phenylphenyl)indazol-6-ol (CID 175464773) is 4-chloro-5-fluoro-1-(2-hydroxy-4-phenylphenyl)indazol-6-ol.
What is the SMILES notation for 4-chloro-5-fluoro-1-(2-hydroxy-4-phenylphenyl)indazol-6-ol?
The canonical SMILES for 4-chloro-5-fluoro-1-(2-hydroxy-4-phenylphenyl)indazol-6-ol is Oc1cc(-c2ccccc2)ccc1-n1ncc2c(Cl)c(F)c(O)cc21.
What is the InChIKey of 4-chloro-5-fluoro-1-(2-hydroxy-4-phenylphenyl)indazol-6-ol?
The InChIKey is QDZJKIQSXQOZAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12ClFN2O2/c20-18-13-10-22-23(15(13)9-17(25)19(18)21)14-7-6-12(8-16(14)24)11-4-2-1-3-5-11/h1-10,24-25H.
What are the key properties of 4-chloro-5-fluoro-1-(2-hydroxy-4-phenylphenyl)indazol-6-ol?
4-chloro-5-fluoro-1-(2-hydroxy-4-phenylphenyl)indazol-6-ol has a molecular weight of 354.77 g/mol, XLogP of 4.90, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-5-fluoro-1-(2-hydroxy-4-phenylphenyl)indazol-6-ol is sourced from PubChem (CID 175464773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).