4-[6-chloro-5-fluoro-1-(2-hydroxyethyl)indazol-3-yl]phenol

C15H12ClFN2O2 — CID 135540460

IUPAC4-[6-chloro-5-fluoro-1-(2-hydroxyethyl)indazol-3-yl]phenol
SMILESOCCn1nc(-c2ccc(O)cc2)c2cc(F)c(Cl)cc21
InChIInChI=1S/C15H12ClFN2O2/c16-12-8-14-11(7-13(12)17)15(18-19(14)5-6-20)9-1-3-10(21)4-2-9/h1-4,7-8,20-21H,5-6H2
InChIKeySBEVKBAZEXMZCH-UHFFFAOYSA-N
MW306.72 g/mol
LogP3.19
Rot. Bonds3

About 4-[6-chloro-5-fluoro-1-(2-hydroxyethyl)indazol-3-yl]phenol

4-[6-chloro-5-fluoro-1-(2-hydroxyethyl)indazol-3-yl]phenol (PubChem CID 135540460) has the molecular formula C15H12ClFN2O2 and a molecular weight of 306.72 g/mol. Its IUPAC name is 4-[6-chloro-5-fluoro-1-(2-hydroxyethyl)indazol-3-yl]phenol.

Molecular Properties

Compound Name4-[6-chloro-5-fluoro-1-(2-hydroxyethyl)indazol-3-yl]phenol
PubChem CID135540460
Molecular FormulaC15H12ClFN2O2
Molecular Weight306.72 g/mol
Exact Mass306.06
IUPAC Name4-[6-chloro-5-fluoro-1-(2-hydroxyethyl)indazol-3-yl]phenol
SMILESOCCn1nc(-c2ccc(O)cc2)c2cc(F)c(Cl)cc21
InChIInChI=1S/C15H12ClFN2O2/c16-12-8-14-11(7-13(12)17)15(18-19(14)5-6-20)9-1-3-10(21)4-2-9/h1-4,7-8,20-21H,5-6H2
InChIKeySBEVKBAZEXMZCH-UHFFFAOYSA-N
XLogP3.19
TPSA58.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.72
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(7-chloro-1-propyl-1H-indazol-3-yl)phenol
CID 135407148
4-(1-butyl-7-chloro-1H-indazol-3-yl)phenol
CID 135458016
Phenol, 4-(7-chloro-1-cyclopentyl-1H-indazol-3-yl)-
CID 135476471
4-(1-benzyl-7-chloro-1H-indazol-3-yl)phenol
CID 135503667
4-(1-cyclopentyl-7-fluoro-1H-indazol-3-yl)phenol
CID 135524867
4-(7-chloro-1-cyclohexyl-1H-indazol-3-yl)phenol
CID 135525228
4-[7-chloro-1-(2-hydroxyethyl)-1H-indazol-3-yl]phenol
CID 135494500
4-[1-(2-hydroxyethyl)-7-(trifluoromethyl)-1H-indazol-3-yl]phenol
CID 135511925
[1-(4-chlorobenzyl)-1H-indazol-3-yl]methanol
CID 12312254
Phenol, 4-[6-chloro-5-fluoro-1-(phenylmethyl)-1H-indazol-3-yl]-
CID 135489142
4-{1-[(4-hydroxyphenyl)methyl]-1H-indazol-3-yl}phenol
CID 673275
(E)-3-[1-[(2,4-dichlorophenyl)methyl]-6-(trifluoromethoxy)indazol-3-yl]prop-2-en-1-ol
CID 11618562

Frequently Asked Questions

What is the IUPAC name of 4-[6-chloro-5-fluoro-1-(2-hydroxyethyl)indazol-3-yl]phenol?
The IUPAC name of 4-[6-chloro-5-fluoro-1-(2-hydroxyethyl)indazol-3-yl]phenol (CID 135540460) is 4-[6-chloro-5-fluoro-1-(2-hydroxyethyl)indazol-3-yl]phenol.
What is the SMILES notation for 4-[6-chloro-5-fluoro-1-(2-hydroxyethyl)indazol-3-yl]phenol?
The canonical SMILES for 4-[6-chloro-5-fluoro-1-(2-hydroxyethyl)indazol-3-yl]phenol is OCCn1nc(-c2ccc(O)cc2)c2cc(F)c(Cl)cc21.
What is the InChIKey of 4-[6-chloro-5-fluoro-1-(2-hydroxyethyl)indazol-3-yl]phenol?
The InChIKey is SBEVKBAZEXMZCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClFN2O2/c16-12-8-14-11(7-13(12)17)15(18-19(14)5-6-20)9-1-3-10(21)4-2-9/h1-4,7-8,20-21H,5-6H2.
What are the key properties of 4-[6-chloro-5-fluoro-1-(2-hydroxyethyl)indazol-3-yl]phenol?
4-[6-chloro-5-fluoro-1-(2-hydroxyethyl)indazol-3-yl]phenol has a molecular weight of 306.72 g/mol, XLogP of 3.19, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-chloro-5-fluoro-1-(2-hydroxyethyl)indazol-3-yl]phenol is sourced from PubChem (CID 135540460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).