4-(4-tert-butylnaphthalen-2-yl)-2-[4-(2,2-dimethylpropyl)phenyl]-[1,3]tellurazolo[5,4-c]pyridine

C31H32N2Te — CID 164733300

IUPAC4-(4-tert-butylnaphthalen-2-yl)-2-[4-(2,2-dimethylpropyl)phenyl]-[1,3]tellurazolo[5,4-c]pyridine
SMILESCC(C)(C)Cc1ccc(-c2nc3ccnc(-c4cc(C(C)(C)C)c5ccccc5c4)c3[te]2)cc1
InChIInChI=1S/C31H32N2Te/c1-30(2,3)19-20-11-13-21(14-12-20)29-33-26-15-16-32-27(28(26)34-29)23-17-22-9-7-8-10-24(22)25(18-23)31(4,5)6/h7-18H,19H2,1-6H3
InChIKeyAKTOQALBJPDUFZ-UHFFFAOYSA-N
MW560.21 g/mol
LogP8.06
Rot. Bonds3

About 4-(4-tert-butylnaphthalen-2-yl)-2-[4-(2,2-dimethylpropyl)phenyl]-[1,3]tellurazolo[5,4-c]pyridine

4-(4-tert-butylnaphthalen-2-yl)-2-[4-(2,2-dimethylpropyl)phenyl]-[1,3]tellurazolo[5,4-c]pyridine (PubChem CID 164733300) has the molecular formula C31H32N2Te and a molecular weight of 560.21 g/mol. Its IUPAC name is 4-(4-tert-butylnaphthalen-2-yl)-2-[4-(2,2-dimethylpropyl)phenyl]-[1,3]tellurazolo[5,4-c]pyridine.

Molecular Properties

Compound Name4-(4-tert-butylnaphthalen-2-yl)-2-[4-(2,2-dimethylpropyl)phenyl]-[1,3]tellurazolo[5,4-c]pyridine
PubChem CID164733300
Molecular FormulaC31H32N2Te
Molecular Weight560.21 g/mol
Exact Mass562.16
IUPAC Name4-(4-tert-butylnaphthalen-2-yl)-2-[4-(2,2-dimethylpropyl)phenyl]-[1,3]tellurazolo[5,4-c]pyridine
SMILESCC(C)(C)Cc1ccc(-c2nc3ccnc(-c4cc(C(C)(C)C)c5ccccc5c4)c3[te]2)cc1
InChIInChI=1S/C31H32N2Te/c1-30(2,3)19-20-11-13-21(14-12-20)29-33-26-15-16-32-27(28(26)34-29)23-17-22-9-7-8-10-24(22)25(18-23)31(4,5)6/h7-18H,19H2,1-6H3
InChIKeyAKTOQALBJPDUFZ-UHFFFAOYSA-N
XLogP8.06
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms34
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500560.21
LogP ≤ 58.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-(4-tert-butylnaphthalen-2-yl)-2-(2,2-dimethylpropyl)-[1,3]tellurazolo[5,4-c]pyridine
CID 164733565
7-(4-tert-butylnaphthalen-2-yl)-4-(2,2-dimethylpropyl)-1,8-phenanthroline
CID 156667246
1-(4-tert-butylnaphthalen-2-yl)-7-(2,2-dimethylpropyl)-2,8-phenanthroline
CID 156667178
9-(4-tert-butylnaphthalen-2-yl)-4-(2,2-dimethylpropyl)-5,7-diselena-3,10-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),3,9,11-pentaene
CID 167427597
1-(4-tert-butylnaphthalen-2-yl)-7-[4-(2,2-dimethylpropyl)-2-methylphenyl]-8-fluoro-[1]benzoselenolo[2,3-c]pyridine
CID 168736821
2-(4-tert-butylnaphthalen-2-yl)-4-[5-(2,2-dimethylpropyl)-1,1-dimethyl-1-benzogermol-2-yl]pyridine
CID 176748893
4-(4-tert-butylnaphthalen-2-yl)-6-[5-[4-(2,2-dimethylpropyl)phenyl]-2-methylthiophen-3-yl]pyrimidine
CID 156665477
7-(4-tert-butylnaphthalen-2-yl)-2-[4-(2,2-dimethylpropyl)-2,6-dimethylphenyl]-3-propan-2-ylthieno[2,3-c]pyridine
CID 163485977
7-(4-tert-butylnaphthalen-2-yl)-3-deuterio-2-[4-(3,3,3-trifluoro-2,2-dimethylpropyl)phenyl]furo[2,3-c]pyridine
CID 170660650
6-(4-tert-butylnaphthalen-2-yl)-4-[2-[4-(2,2-dimethylpropyl)phenyl]-1,3-thiazol-5-yl]pyridine-3-carbonitrile
CID 164796395
7-(4-tert-butylnaphthalen-2-yl)-2-iodofuro[2,3-c]pyridine
CID 170660676
4-(4-tert-butylnaphthalen-2-yl)-7-(2,2-dimethylpropyl)-5,5-dimethyl-[1]benzogermolo[3,2-d]pyrimidine
CID 172528345

Frequently Asked Questions

What is the IUPAC name of 4-(4-tert-butylnaphthalen-2-yl)-2-[4-(2,2-dimethylpropyl)phenyl]-[1,3]tellurazolo[5,4-c]pyridine?
The IUPAC name of 4-(4-tert-butylnaphthalen-2-yl)-2-[4-(2,2-dimethylpropyl)phenyl]-[1,3]tellurazolo[5,4-c]pyridine (CID 164733300) is 4-(4-tert-butylnaphthalen-2-yl)-2-[4-(2,2-dimethylpropyl)phenyl]-[1,3]tellurazolo[5,4-c]pyridine.
What is the SMILES notation for 4-(4-tert-butylnaphthalen-2-yl)-2-[4-(2,2-dimethylpropyl)phenyl]-[1,3]tellurazolo[5,4-c]pyridine?
The canonical SMILES for 4-(4-tert-butylnaphthalen-2-yl)-2-[4-(2,2-dimethylpropyl)phenyl]-[1,3]tellurazolo[5,4-c]pyridine is CC(C)(C)Cc1ccc(-c2nc3ccnc(-c4cc(C(C)(C)C)c5ccccc5c4)c3[te]2)cc1.
What is the InChIKey of 4-(4-tert-butylnaphthalen-2-yl)-2-[4-(2,2-dimethylpropyl)phenyl]-[1,3]tellurazolo[5,4-c]pyridine?
The InChIKey is AKTOQALBJPDUFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H32N2Te/c1-30(2,3)19-20-11-13-21(14-12-20)29-33-26-15-16-32-27(28(26)34-29)23-17-22-9-7-8-10-24(22)25(18-23)31(4,5)6/h7-18H,19H2,1-6H3.
What are the key properties of 4-(4-tert-butylnaphthalen-2-yl)-2-[4-(2,2-dimethylpropyl)phenyl]-[1,3]tellurazolo[5,4-c]pyridine?
4-(4-tert-butylnaphthalen-2-yl)-2-[4-(2,2-dimethylpropyl)phenyl]-[1,3]tellurazolo[5,4-c]pyridine has a molecular weight of 560.21 g/mol, XLogP of 8.06, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-tert-butylnaphthalen-2-yl)-2-[4-(2,2-dimethylpropyl)phenyl]-[1,3]tellurazolo[5,4-c]pyridine is sourced from PubChem (CID 164733300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).