4-(1H-indazol-6-yl)-2-phenylmethoxyphenol

C20H16N2O2 — CID 142654170

IUPAC4-(1H-indazol-6-yl)-2-phenylmethoxyphenol
SMILESOc1ccc(-c2ccc3cn[nH]c3c2)cc1OCc1ccccc1
InChIInChI=1S/C20H16N2O2/c23-19-9-8-16(15-6-7-17-12-21-22-18(17)10-15)11-20(19)24-13-14-4-2-1-3-5-14/h1-12,23H,13H2,(H,21,22)
InChIKeyDXNUSZUWHIQVGW-UHFFFAOYSA-N
MW316.36 g/mol
LogP4.51
Rot. Bonds4

About 4-(1H-indazol-6-yl)-2-phenylmethoxyphenol

4-(1H-indazol-6-yl)-2-phenylmethoxyphenol (PubChem CID 142654170) has the molecular formula C20H16N2O2 and a molecular weight of 316.36 g/mol. Its IUPAC name is 4-(1H-indazol-6-yl)-2-phenylmethoxyphenol.

Molecular Properties

Compound Name4-(1H-indazol-6-yl)-2-phenylmethoxyphenol
PubChem CID142654170
Molecular FormulaC20H16N2O2
Molecular Weight316.36 g/mol
Exact Mass316.12
IUPAC Name4-(1H-indazol-6-yl)-2-phenylmethoxyphenol
SMILESOc1ccc(-c2ccc3cn[nH]c3c2)cc1OCc1ccccc1
InChIInChI=1S/C20H16N2O2/c23-19-9-8-16(15-6-7-17-12-21-22-18(17)10-15)11-20(19)24-13-14-4-2-1-3-5-14/h1-12,23H,13H2,(H,21,22)
InChIKeyDXNUSZUWHIQVGW-UHFFFAOYSA-N
XLogP4.51
TPSA58.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 54.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-hydroxy-3-phenylmethoxyphenyl)-3H-quinazolin-4-one
CID 168550890
2-methoxy-4-(3-methyl-4-phenylmethoxyphenyl)phenol
CID 145389555
5-phenyl-2-phenylmethoxyphenol
CID 11994792
6-phenylmethoxy-7-(3-phenylmethoxyprop-1-ynyl)-1H-indazole
CID 163259451
(4-phenylmethoxy-1H-indazol-6-yl)boronic acid
CID 155673029
4-tert-butyl-2-phenylmethoxyphenol
CID 18795860
2-phenylmethoxy-4-(1H-pyrazol-4-yl)benzamide
CID 68761090
4-butan-2-yl-2-phenylmethoxyphenol
CID 58776827
6-bromo-2-(3-methoxy-4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine
CID 69214242
N-(1H-indazol-6-ylmethyl)-2-phenylacetamide
CID 110472122
1-(2-hydroxy-8-phenylmethoxynaphthalen-1-yl)-8-phenylmethoxynaphthalen-2-ol
CID 71528265
N-(1-phenylpropan-2-yl)-1H-indazole-6-carboxamide
CID 63010618

Frequently Asked Questions

What is the IUPAC name of 4-(1H-indazol-6-yl)-2-phenylmethoxyphenol?
The IUPAC name of 4-(1H-indazol-6-yl)-2-phenylmethoxyphenol (CID 142654170) is 4-(1H-indazol-6-yl)-2-phenylmethoxyphenol.
What is the SMILES notation for 4-(1H-indazol-6-yl)-2-phenylmethoxyphenol?
The canonical SMILES for 4-(1H-indazol-6-yl)-2-phenylmethoxyphenol is Oc1ccc(-c2ccc3cn[nH]c3c2)cc1OCc1ccccc1.
What is the InChIKey of 4-(1H-indazol-6-yl)-2-phenylmethoxyphenol?
The InChIKey is DXNUSZUWHIQVGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O2/c23-19-9-8-16(15-6-7-17-12-21-22-18(17)10-15)11-20(19)24-13-14-4-2-1-3-5-14/h1-12,23H,13H2,(H,21,22).
What are the key properties of 4-(1H-indazol-6-yl)-2-phenylmethoxyphenol?
4-(1H-indazol-6-yl)-2-phenylmethoxyphenol has a molecular weight of 316.36 g/mol, XLogP of 4.51, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1H-indazol-6-yl)-2-phenylmethoxyphenol is sourced from PubChem (CID 142654170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).