2,4-bis[(4-methoxyphenyl)tellanyl]-3-phenylquinoline

C29H23NO2Te2 — CID 53387645

IUPAC2,4-bis[(4-methoxyphenyl)tellanyl]-3-phenylquinoline
SMILESCOc1ccc([Te]c2nc3ccccc3c([Te]c3ccc(OC)cc3)c2-c2ccccc2)cc1
InChIInChI=1S/C29H23NO2Te2/c1-31-21-12-16-23(17-13-21)33-28-25-10-6-7-11-26(25)30-29(27(28)20-8-4-3-5-9-20)34-24-18-14-22(32-2)15-19-24/h3-19H,1-2H3
InChIKeyNAEMXKXZJUVCMU-UHFFFAOYSA-N
MW672.71 g/mol
LogP3.23
Rot. Bonds7

About 2,4-bis[(4-methoxyphenyl)tellanyl]-3-phenylquinoline

2,4-bis[(4-methoxyphenyl)tellanyl]-3-phenylquinoline (PubChem CID 53387645) has the molecular formula C29H23NO2Te2 and a molecular weight of 672.71 g/mol. Its IUPAC name is 2,4-bis[(4-methoxyphenyl)tellanyl]-3-phenylquinoline.

Molecular Properties

Compound Name2,4-bis[(4-methoxyphenyl)tellanyl]-3-phenylquinoline
PubChem CID53387645
Molecular FormulaC29H23NO2Te2
Molecular Weight672.71 g/mol
Exact Mass676.99
IUPAC Name2,4-bis[(4-methoxyphenyl)tellanyl]-3-phenylquinoline
SMILESCOc1ccc([Te]c2nc3ccccc3c([Te]c3ccc(OC)cc3)c2-c2ccccc2)cc1
InChIInChI=1S/C29H23NO2Te2/c1-31-21-12-16-23(17-13-21)33-28-25-10-6-7-11-26(25)30-29(27(28)20-8-4-3-5-9-20)34-24-18-14-22(32-2)15-19-24/h3-19H,1-2H3
InChIKeyNAEMXKXZJUVCMU-UHFFFAOYSA-N
XLogP3.23
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500672.71
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

3-(4-methylphenyl)-2,4-bis(phenyltellanyl)quinoline
CID 101491869
1-[4-(4-methoxyphenyl)phenyl]-2,4,6-triphenyl-3,5-bis(4-phenylphenyl)benzene
CID 138981847
4-(4-methoxyphenyl)-2-phenylquinoline
CID 12523263
1-methoxy-4-(4-methoxyphenyl)tellanylbenzene;dihydrochloride
CID 88732115
2,3-bis(4-methoxyphenyl)quinoline-4-carboxylic acid
CID 95560580
11-(4-methoxyphenyl)-[1]benzofuro[3,2-b]quinoline
CID 11809524
2-(4-methoxyphenyl)-4-methylquinazoline
CID 15566164
1-methoxy-4-[(4-methoxyphenyl)ditellanyl]benzene
CID 2724786
1-[4-(4-methoxyphenyl)-2-methylquinolin-3-yl]ethanone
CID 672266
2-[10-(4-methoxyphenyl)anthracen-9-yl]quinoxaline
CID 129060956
7,12-bis(4-methoxyphenyl)benzo[j]phenanthridine
CID 59182915
2-(4-methoxyphenyl)-3,4-dimethylquinoline;hydrochloride
CID 42918992

Frequently Asked Questions

What is the IUPAC name of 2,4-bis[(4-methoxyphenyl)tellanyl]-3-phenylquinoline?
The IUPAC name of 2,4-bis[(4-methoxyphenyl)tellanyl]-3-phenylquinoline (CID 53387645) is 2,4-bis[(4-methoxyphenyl)tellanyl]-3-phenylquinoline.
What is the SMILES notation for 2,4-bis[(4-methoxyphenyl)tellanyl]-3-phenylquinoline?
The canonical SMILES for 2,4-bis[(4-methoxyphenyl)tellanyl]-3-phenylquinoline is COc1ccc([Te]c2nc3ccccc3c([Te]c3ccc(OC)cc3)c2-c2ccccc2)cc1.
What is the InChIKey of 2,4-bis[(4-methoxyphenyl)tellanyl]-3-phenylquinoline?
The InChIKey is NAEMXKXZJUVCMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H23NO2Te2/c1-31-21-12-16-23(17-13-21)33-28-25-10-6-7-11-26(25)30-29(27(28)20-8-4-3-5-9-20)34-24-18-14-22(32-2)15-19-24/h3-19H,1-2H3.
What are the key properties of 2,4-bis[(4-methoxyphenyl)tellanyl]-3-phenylquinoline?
2,4-bis[(4-methoxyphenyl)tellanyl]-3-phenylquinoline has a molecular weight of 672.71 g/mol, XLogP of 3.23, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-bis[(4-methoxyphenyl)tellanyl]-3-phenylquinoline is sourced from PubChem (CID 53387645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).