3-[(4-methoxyphenyl)methoxy]-1-[(4-methoxyphenyl)methyl]indazole

C23H22N2O3 — CID 51357040

IUPAC3-[(4-methoxyphenyl)methoxy]-1-[(4-methoxyphenyl)methyl]indazole
SMILESCOc1ccc(COc2nn(Cc3ccc(OC)cc3)c3ccccc23)cc1
InChIInChI=1S/C23H22N2O3/c1-26-19-11-7-17(8-12-19)15-25-22-6-4-3-5-21(22)23(24-25)28-16-18-9-13-20(27-2)14-10-18/h3-14H,15-16H2,1-2H3
InChIKeyGSTMDKTUYLEMNX-UHFFFAOYSA-N
MW374.44 g/mol
LogP4.68
Rot. Bonds7

About 3-[(4-methoxyphenyl)methoxy]-1-[(4-methoxyphenyl)methyl]indazole

3-[(4-methoxyphenyl)methoxy]-1-[(4-methoxyphenyl)methyl]indazole (PubChem CID 51357040) has the molecular formula C23H22N2O3 and a molecular weight of 374.44 g/mol. Its IUPAC name is 3-[(4-methoxyphenyl)methoxy]-1-[(4-methoxyphenyl)methyl]indazole.

Molecular Properties

Compound Name3-[(4-methoxyphenyl)methoxy]-1-[(4-methoxyphenyl)methyl]indazole
PubChem CID51357040
Molecular FormulaC23H22N2O3
Molecular Weight374.44 g/mol
Exact Mass374.16
IUPAC Name3-[(4-methoxyphenyl)methoxy]-1-[(4-methoxyphenyl)methyl]indazole
SMILESCOc1ccc(COc2nn(Cc3ccc(OC)cc3)c3ccccc23)cc1
InChIInChI=1S/C23H22N2O3/c1-26-19-11-7-17(8-12-19)15-25-22-6-4-3-5-21(22)23(24-25)28-16-18-9-13-20(27-2)14-10-18/h3-14H,15-16H2,1-2H3
InChIKeyGSTMDKTUYLEMNX-UHFFFAOYSA-N
XLogP4.68
TPSA45.51 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.44
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-methoxy-1-[(4-methoxyphenyl)methyl]indazole
CID 174608051
1-benzyl-3-(3-chloropropoxy)indazole;hydrochloride
CID 71371657
1-[(4-methoxyphenyl)methyl]indazole-3-carboximidamide
CID 86732415
3-(1-benzylindazol-3-yl)oxy-N,N-dimethylpropan-1-amine
CID 12555
2-(1-benzylindazol-3-yl)oxyacetamide
CID 57182784
1-benzyl-3-prop-1-enoxyindazole
CID 53421497
5-amino-1-[(4-fluorophenyl)methyl]-3-[(4-methoxyphenyl)methoxy]pyrazole-4-carbonitrile
CID 100765180
5-bromo-1-[(4-methoxyphenyl)methyl]-3-phenylindazole
CID 162528409
2-[(4-methoxyphenyl)methyl]-3-(4-methylphenyl)indazole
CID 11645597
1-methoxy-4-[(4-phenylmethoxyphenoxy)methyl]benzene
CID 12029541
1,4-diethoxy-2-[(4-methoxyphenyl)methyl]pyrazolo[3,4-c]quinoline
CID 70976924
3-(4-methoxyphenyl)-6-phenylmethoxy-[1,2,4]triazolo[3,4-a]phthalazine
CID 11372475

Frequently Asked Questions

What is the IUPAC name of 3-[(4-methoxyphenyl)methoxy]-1-[(4-methoxyphenyl)methyl]indazole?
The IUPAC name of 3-[(4-methoxyphenyl)methoxy]-1-[(4-methoxyphenyl)methyl]indazole (CID 51357040) is 3-[(4-methoxyphenyl)methoxy]-1-[(4-methoxyphenyl)methyl]indazole.
What is the SMILES notation for 3-[(4-methoxyphenyl)methoxy]-1-[(4-methoxyphenyl)methyl]indazole?
The canonical SMILES for 3-[(4-methoxyphenyl)methoxy]-1-[(4-methoxyphenyl)methyl]indazole is COc1ccc(COc2nn(Cc3ccc(OC)cc3)c3ccccc23)cc1.
What is the InChIKey of 3-[(4-methoxyphenyl)methoxy]-1-[(4-methoxyphenyl)methyl]indazole?
The InChIKey is GSTMDKTUYLEMNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O3/c1-26-19-11-7-17(8-12-19)15-25-22-6-4-3-5-21(22)23(24-25)28-16-18-9-13-20(27-2)14-10-18/h3-14H,15-16H2,1-2H3.
What are the key properties of 3-[(4-methoxyphenyl)methoxy]-1-[(4-methoxyphenyl)methyl]indazole?
3-[(4-methoxyphenyl)methoxy]-1-[(4-methoxyphenyl)methyl]indazole has a molecular weight of 374.44 g/mol, XLogP of 4.68, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-methoxyphenyl)methoxy]-1-[(4-methoxyphenyl)methyl]indazole is sourced from PubChem (CID 51357040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).