9-(4-tert-butyltelluropheno[2,3-b]pyridin-6-yl)carbazol-2-ol

C23H20N2OTe — CID 167378737

IUPAC9-(4-tert-butyltelluropheno[2,3-b]pyridin-6-yl)carbazol-2-ol
SMILESCC(C)(C)c1cc(-n2c3ccccc3c3ccc(O)cc32)nc2[te]ccc12
InChIInChI=1S/C23H20N2OTe/c1-23(2,3)18-13-21(24-22-17(18)10-11-27-22)25-19-7-5-4-6-15(19)16-9-8-14(26)12-20(16)25/h4-13,26H,1-3H3
InChIKeyZKUPZVDTBAUNDO-UHFFFAOYSA-N
MW468.03 g/mol
LogP5.39
Rot. Bonds1

About 9-(4-tert-butyltelluropheno[2,3-b]pyridin-6-yl)carbazol-2-ol

9-(4-tert-butyltelluropheno[2,3-b]pyridin-6-yl)carbazol-2-ol (PubChem CID 167378737) has the molecular formula C23H20N2OTe and a molecular weight of 468.03 g/mol. Its IUPAC name is 9-(4-tert-butyltelluropheno[2,3-b]pyridin-6-yl)carbazol-2-ol.

Molecular Properties

Compound Name9-(4-tert-butyltelluropheno[2,3-b]pyridin-6-yl)carbazol-2-ol
PubChem CID167378737
Molecular FormulaC23H20N2OTe
Molecular Weight468.03 g/mol
Exact Mass470.06
IUPAC Name9-(4-tert-butyltelluropheno[2,3-b]pyridin-6-yl)carbazol-2-ol
SMILESCC(C)(C)c1cc(-n2c3ccccc3c3ccc(O)cc32)nc2[te]ccc12
InChIInChI=1S/C23H20N2OTe/c1-23(2,3)18-13-21(24-22-17(18)10-11-27-22)25-19-7-5-4-6-15(19)16-9-8-14(26)12-20(16)25/h4-13,26H,1-3H3
InChIKeyZKUPZVDTBAUNDO-UHFFFAOYSA-N
XLogP5.39
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500468.03
LogP ≤ 55.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 9-(4-tert-butyltelluropheno[2,3-b]pyridin-6-yl)carbazol-2-ol?
The IUPAC name of 9-(4-tert-butyltelluropheno[2,3-b]pyridin-6-yl)carbazol-2-ol (CID 167378737) is 9-(4-tert-butyltelluropheno[2,3-b]pyridin-6-yl)carbazol-2-ol.
What is the SMILES notation for 9-(4-tert-butyltelluropheno[2,3-b]pyridin-6-yl)carbazol-2-ol?
The canonical SMILES for 9-(4-tert-butyltelluropheno[2,3-b]pyridin-6-yl)carbazol-2-ol is CC(C)(C)c1cc(-n2c3ccccc3c3ccc(O)cc32)nc2[te]ccc12.
What is the InChIKey of 9-(4-tert-butyltelluropheno[2,3-b]pyridin-6-yl)carbazol-2-ol?
The InChIKey is ZKUPZVDTBAUNDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2OTe/c1-23(2,3)18-13-21(24-22-17(18)10-11-27-22)25-19-7-5-4-6-15(19)16-9-8-14(26)12-20(16)25/h4-13,26H,1-3H3.
What are the key properties of 9-(4-tert-butyltelluropheno[2,3-b]pyridin-6-yl)carbazol-2-ol?
9-(4-tert-butyltelluropheno[2,3-b]pyridin-6-yl)carbazol-2-ol has a molecular weight of 468.03 g/mol, XLogP of 5.39, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-tert-butyltelluropheno[2,3-b]pyridin-6-yl)carbazol-2-ol is sourced from PubChem (CID 167378737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).