4-(7-bromo-2H-indazol-3-yl)phenol

C13H9BrN2O — CID 136705355

IUPAC4-(7-bromo-2H-indazol-3-yl)phenol
SMILESOc1ccc(-c2[nH]nc3c(Br)cccc23)cc1
InChIInChI=1S/C13H9BrN2O/c14-11-3-1-2-10-12(15-16-13(10)11)8-4-6-9(17)7-5-8/h1-7,17H,(H,15,16)
InChIKeyFLMJYDLZMQHENA-UHFFFAOYSA-N
MW289.13 g/mol
LogP3.70
Rot. Bonds1

About 4-(7-bromo-2H-indazol-3-yl)phenol

4-(7-bromo-2H-indazol-3-yl)phenol (PubChem CID 136705355) has the molecular formula C13H9BrN2O and a molecular weight of 289.13 g/mol. Its IUPAC name is 4-(7-bromo-2H-indazol-3-yl)phenol.

Molecular Properties

Compound Name4-(7-bromo-2H-indazol-3-yl)phenol
PubChem CID136705355
Molecular FormulaC13H9BrN2O
Molecular Weight289.13 g/mol
Exact Mass287.99
IUPAC Name4-(7-bromo-2H-indazol-3-yl)phenol
SMILESOc1ccc(-c2[nH]nc3c(Br)cccc23)cc1
InChIInChI=1S/C13H9BrN2O/c14-11-3-1-2-10-12(15-16-13(10)11)8-4-6-9(17)7-5-8/h1-7,17H,(H,15,16)
InChIKeyFLMJYDLZMQHENA-UHFFFAOYSA-N
XLogP3.70
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.13
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

8-bromo-2-(4-hydroxyphenyl)-3H-quinazolin-4-one
CID 178071051
1-(7-bromo-2H-indazol-3-yl)ethanamine
CID 83912564
(7-bromo-2H-indazol-3-yl)-(4-chlorophenyl)methanone
CID 70874197
3-(7-bromo-2H-indazol-3-yl)-2-methylpropanoic acid
CID 84730633
4-[3-(4-chlorophenyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]phenol
CID 155539013
4-(3-amino-5-bromo-1H-indazol-6-yl)phenol
CID 135848027
4-[(8-bromo-2-methylquinolin-4-yl)amino]phenol
CID 978277
4-[3-(4-hydroxyanilino)-5-(4-hydroxyphenyl)-1H-pyrazol-4-yl]phenol
CID 135566832
4-[4-(4-hydroxyphenyl)phenyl]phenol
CID 14496018
2-(7-fluoro-2H-indazol-3-yl)-5-phenyl-1,3-thiazol-4-ol
CID 22259261
4-[3-amino-6-(4-hydroxyphenyl)-1H-indazol-5-yl]phenol
CID 135848029
4-[2-(4-phenylphenyl)-1H-indol-3-yl]phenol
CID 132917859

Frequently Asked Questions

What is the IUPAC name of 4-(7-bromo-2H-indazol-3-yl)phenol?
The IUPAC name of 4-(7-bromo-2H-indazol-3-yl)phenol (CID 136705355) is 4-(7-bromo-2H-indazol-3-yl)phenol.
What is the SMILES notation for 4-(7-bromo-2H-indazol-3-yl)phenol?
The canonical SMILES for 4-(7-bromo-2H-indazol-3-yl)phenol is Oc1ccc(-c2[nH]nc3c(Br)cccc23)cc1.
What is the InChIKey of 4-(7-bromo-2H-indazol-3-yl)phenol?
The InChIKey is FLMJYDLZMQHENA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9BrN2O/c14-11-3-1-2-10-12(15-16-13(10)11)8-4-6-9(17)7-5-8/h1-7,17H,(H,15,16).
What are the key properties of 4-(7-bromo-2H-indazol-3-yl)phenol?
4-(7-bromo-2H-indazol-3-yl)phenol has a molecular weight of 289.13 g/mol, XLogP of 3.70, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(7-bromo-2H-indazol-3-yl)phenol is sourced from PubChem (CID 136705355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).